data_1qvx_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 1qvx _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.603 ' CG ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 16.7 m -59.05 141.13 54.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 166.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.75 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.32 82.02 0.15 Allowed 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 122.313 0.245 . . . . 0.0 111.422 -174.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 925' ' ' VAL . 3.3 t70 -46.23 -174.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 O-C-N 126.028 2.08 . . . . 0.0 113.055 -170.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.548 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.2 tmtp? -42.97 -19.38 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.281 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.887 ' HA ' HG22 ' A' ' 968' ' ' THR . 2.3 m -60.15 -56.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.867 174.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.446 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 57.3 t80 -78.67 -25.03 44.82 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.425 1.107 . . . . 0.0 108.508 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 98.3 mt-10 -63.6 -62.82 1.42 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.799 -1.546 . . . . 0.0 111.807 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.42 -32.94 66.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.196 -0.456 . . . . 0.0 112.188 -171.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.786 HG21 HD12 ' A' 1039 ' ' ILE . 19.0 m -60.65 -36.47 70.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.727 0.299 . . . . 0.0 111.512 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.646 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.5 m -61.45 -36.9 81.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 171.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.95 63.24 Favored Glycine 0 CA--C 1.522 0.504 0 CA-C-N 114.558 -1.201 . . . . 0.0 113.279 175.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 1.015 HD13 HD23 ' A' ' 965' ' ' LEU . 3.1 tt -63.86 -50.74 67.64 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.504 ' O ' HG22 ' A' ' 936' ' ' VAL . 39.4 t -58.51 -42.02 83.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.083 0.468 . . . . 0.0 110.316 178.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.646 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -63.19 -28.81 70.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.115 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.558 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.37 -25.45 42.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.466 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.539 ' HA ' HG11 ' A' ' 958' ' ' VAL . 0.9 OUTLIER -78.75 -14.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.227 173.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 70.3 mt -69.59 -35.31 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 168.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.558 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 13.7 mm-40 -54.59 -38.43 66.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.284 171.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.888 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 44.4 ttm -58.02 -43.36 86.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.144 0.497 . . . . 0.0 110.04 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.645 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 14.0 m -68.33 -39.95 81.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.043 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.51 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 17.2 p -76.93 -35.94 56.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -173.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 7.4 mmtp -54.78 -47.92 73.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.516 -1.22 . . . . 0.0 112.147 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.778 ' HB ' ' HE3' ' A' ' 954' ' ' MET . 10.8 tt -71.24 -24.37 24.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.435 -174.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.691 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 85.1 mt-30 -57.52 -57.88 22.14 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.691 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.9 Cg_endo -96.2 -16.31 0.38 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.46 1.44 . . . . 0.0 114.124 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.503 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -103.35 158.33 32.03 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -171.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.757 ' HG2' ' HG2' ' A' ' 949' ' ' GLU . 84.0 Cg_endo -92.31 -174.97 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 123.804 3.003 . . . . 0.0 113.155 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.628 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 81.7 Cg_exo -49.83 -31.64 27.05 Favored 'Trans proline' 0 C--N 1.363 1.291 0 C-N-CA 123.719 2.946 . . . . 0.0 114.885 -178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.757 ' HG2' ' HG2' ' A' ' 947' ' ' PRO . 11.7 pt-20 -55.48 -29.5 58.88 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.634 176.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.603 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 51.0 mm-40 -98.14 -5.54 33.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.604 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 1.023 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 2.8 m-85 -55.0 -46.08 75.12 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.002 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -70.1 -51.96 13.36 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 119.267 -0.973 . . . . 0.0 112.324 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.002 ' HD3' HG12 ' A' ' 952' ' ' VAL . 87.9 Cg_exo -53.04 -31.98 56.32 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.731 2.287 . . . . 0.0 115.158 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 1.023 ' HE2' ' HA ' ' A' ' 951' ' ' TYR . 20.7 ptp -64.8 -39.83 94.23 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.021 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.615 ' O ' HG22 ' A' ' 958' ' ' VAL . 65.7 t -67.12 -28.01 41.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.917 169.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.9 tptm -65.25 -33.82 76.89 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.6 mm-40 -56.31 -47.38 78.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.971 174.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 955' ' ' VAL . 3.2 m -70.36 -25.15 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.437 174.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.613 ' HA2' HD23 ' A' ' 995' ' ' LEU . . . -69.03 -45.81 61.28 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.083 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.413 ' O ' HD12 ' A' ' 960' ' ' LEU . 2.3 tm? -62.35 -30.49 71.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.961 0.41 . . . . 0.0 109.917 171.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.7 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -57.18 -57.01 14.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.072 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.909 ' HB2' HD13 ' A' ' 995' ' ' LEU . 2.9 tm? -60.55 -40.62 92.22 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.578 177.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -50.39 -56.59 10.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.555 0.693 . . . . 0.0 110.894 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.9 m -53.35 -40.51 64.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.238 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 1.015 HD23 HD13 ' A' ' 932' ' ' LEU . 6.3 mp -68.3 -27.22 66.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.523 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.8 tt -56.96 -36.13 69.94 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.53 97.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.284 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.887 HG22 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -62.23 -41.4 98.37 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.809 173.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.434 HG21 ' O ' ' A' ' 965' ' ' LEU . 87.9 t -55.11 -31.85 26.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.927 174.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.9 t70 -75.84 -34.09 60.08 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.129 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.572 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.8 mm-40 -59.73 -53.13 61.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.515 1.15 . . . . 0.0 108.762 172.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.47 ' OG ' HG22 ' A' ' 980' ' ' THR . 41.0 t -67.57 -22.3 65.4 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.756 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.697 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 28.7 tp -53.3 -55.62 32.57 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 118.579 -0.725 . . . . 0.0 112.144 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 35.4 Cg_exo -63.8 -23.8 68.8 Favored 'Trans proline' 0 C--N 1.358 1.069 0 CA-C-N 121.127 1.438 . . . . 0.0 111.02 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.53 HG12 ' HB2' ' A' 1046 ' ' MET . 11.5 t -77.51 -8.62 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.162 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 1.4 pp -83.47 -40.14 0.77 Allowed Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.363 -0.836 . . . . 0.0 111.951 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.58 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 18.3 Cg_endo -63.99 -23.91 67.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 120.797 1.321 . . . . 0.0 110.133 168.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . 0.448 ' HB2' ' O ' ' A' ' 975' ' ' VAL . . . -64.87 -62.68 1.42 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.148 169.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.82 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.4 m -165.76 -32.31 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.648 HG23 ' HB ' ' A' ' 984' ' ' ILE . 3.4 m -57.27 -18.22 15.47 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.601 ' HA ' HG21 ' A' ' 984' ' ' ILE . 15.0 p-80 -48.71 -20.75 0.5 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -174.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -70.97 -57.41 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.486 177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.959 ' HG2' HG21 ' A' 1038 ' ' VAL . 0.0 OUTLIER -82.91 -34.5 26.61 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -178.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.648 ' HB ' HG23 ' A' ' 980' ' ' THR . 10.2 tp -61.76 -24.48 34.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -74.78 -48.98 22.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 168.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.752 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 10.6 ptp -63.84 -44.81 92.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.781 -171.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.791 ' HB3' HG23 ' A' 1038 ' ' VAL . . . -78.71 -46.01 19.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 1.055 ' HA ' HD13 ' A' ' 991' ' ' LEU . 22.8 tm0? -62.87 -43.77 97.91 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.87 -175.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 54.3 mttp -62.33 -33.9 75.59 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.341 0.591 . . . . 0.0 109.7 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.541 ' HG ' ' CB ' ' A' 1031 ' ' ASP . 3.6 tp -71.49 -38.82 71.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.744 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.055 HD13 ' HA ' ' A' ' 988' ' ' GLN . 5.6 mt -61.79 -51.59 67.66 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.493 0.663 . . . . 0.0 109.451 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.425 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 33.0 t30 -55.49 -45.12 77.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.065 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.647 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 50.0 m -64.64 -48.44 74.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.168 -177.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.34 -40.13 8.06 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -167.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.909 HD13 ' HB2' ' A' ' 962' ' ' LEU . 3.5 tt -60.99 -41.14 95.9 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.723 175.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.425 ' HB1' ' O ' ' A' ' 992' ' ' ASN . . . -61.43 -42.57 98.95 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.647 ' HG2' ' O ' ' A' ' 993' ' ' SER . 68.4 mm-40 -52.39 -48.35 65.69 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.088 175.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.526 ' O ' HG11 ' A' ' 955' ' ' VAL . 4.0 mm? -58.55 -37.26 75.32 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 110.191 -175.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.04 -44.43 87.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.195 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.693 ' O ' ' HB2' ' A' 1004 ' ' LEU . 16.6 m-80 -93.81 -11.17 31.86 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.483 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' 1001 ' ' LYS . 36.1 mmtm -85.97 -40.66 15.61 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.281 -0.168 . . . . 0.0 111.316 -176.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.812 ' HE2' ' HE3' ' A' 1021 ' ' MET . 42.5 tpp -77.44 -36.5 53.01 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 172.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.813 ' O ' ' HB2' ' A' 1007 ' ' GLN . 63.0 tttp -53.87 -53.4 53.05 Favored 'General case' 0 C--O 1.211 -0.939 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 171.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.7 tt -53.06 -52.2 59.31 Favored 'General case' 0 C--O 1.22 -0.482 0 O-C-N 123.932 0.77 . . . . 0.0 111.336 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.483 ' O ' ' HD2' ' A' 1017 ' ' TYR . . . -55.76 -52.22 64.7 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.09 0.472 . . . . 0.0 109.939 -178.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.578 ' NE2' ' HB3' ' A' ' 948' ' ' PRO . 7.4 mm100 -72.74 -9.83 59.09 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.626 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.813 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.8 tp-100 -95.34 -27.44 15.46 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.399 0.619 . . . . 0.0 110.823 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 23.4 t80 . . . . . 0 C--N 1.315 -0.926 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.406 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 8.7 tp60 . . . . . 0 N--CA 1.461 0.1 0 CA-C-O 121.452 0.644 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' 1019 ' ' LYS . 12.4 pt20 -70.22 -26.6 63.94 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.918 -177.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.74 -53.82 46.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.586 0.231 . . . . 0.0 110.875 166.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.483 ' HD2' ' O ' ' A' 1005 ' ' ALA . 0.4 OUTLIER -64.1 -25.16 67.98 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.609 ' HE2' ' HE1' ' A' 1002 ' ' MET . 28.8 tptp -74.42 -25.29 59.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.389 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' 1015 ' ' GLN . 34.7 mmtp -68.55 -57.67 5.43 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -50.26 -35.08 25.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.323 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.812 ' HE3' ' HE2' ' A' 1002 ' ' MET . 1.7 tmt? -66.4 -43.58 85.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.765 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 41.3 tp -64.49 -39.25 93.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.756 0.312 . . . . 0.0 110.954 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 41.1 m -63.05 -32.88 74.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.596 0.713 . . . . 0.0 110.335 175.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.503 ' O ' HD23 ' A' ' 998' ' ' LEU . . . -78.12 -39.77 40.23 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.812 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.4 -35.18 75.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.78 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.558 ' O ' HG21 ' A' 1030 ' ' VAL . 11.2 t-80 -62.97 -39.2 93.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.898 174.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.8 82.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.52 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.778 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.94 -34.28 71.32 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.317 0.579 . . . . 0.0 110.296 179.297 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.626 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.59 -32.78 65.56 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.629 -0.67 . . . . 0.0 110.666 171.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.558 HG21 ' O ' ' A' 1026 ' ' HIS . 99.3 t -71.7 -27.99 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.68 175.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.541 ' CB ' ' HG ' ' A' ' 990' ' ' LEU . 2.5 p30 -74.27 -40.92 62.01 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.632 -0.827 . . . . 0.0 109.478 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -60.28 -49.65 76.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.679 ' O ' ' HG ' ' A' 1036 ' ' LEU . 54.1 tptt -59.97 -49.48 77.53 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.787 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.697 ' O ' HG22 ' A' 1038 ' ' VAL . 65.9 t30 -62.76 -43.61 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.378 -176.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.848 HD23 HD12 ' A' ' 991' ' ' LEU . 19.1 tp -72.82 -38.08 67.29 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.031 -175.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.733 ' HA ' HD12 ' A' 1039 ' ' ILE . 3.5 pp -61.0 -19.55 61.45 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 120.688 0.28 . . . . 0.0 110.586 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -98.52 -33.96 10.79 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.959 HG21 ' HG2' ' A' ' 983' ' ' GLU . 19.9 t -53.11 -58.9 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.875 172.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.807 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -83.19 -24.32 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.749 -177.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.79 ' H ' HD13 ' A' 1039 ' ' ILE . 8.6 t70 -58.12 -42.21 85.26 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 163.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.554 ' O ' ' HG2' ' A' 1045 ' ' LYS . 36.5 mt-30 -68.29 -34.73 76.7 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.888 172.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.718 ' HA ' ' HG2' ' A' 1045 ' ' LYS . . . -52.39 -51.61 58.1 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.891 0.377 . . . . 0.0 110.952 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.75 ' HG3' ' HA ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER -47.28 -41.48 18.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.378 172.102 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.7 ' N ' ' HD3' ' A' 1043 ' ' ARG . 28.0 tp -80.37 -26.64 38.51 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.966 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.82 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.0 mmmt -64.32 -39.94 94.92 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.53 ' HB2' HG12 ' A' ' 975' ' ' VAL . 13.7 tmm? -63.2 -43.32 98.48 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.705 176.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 41.8 mm -62.71 -44.17 99.25 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 173.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.6 m -47.83 -45.17 29.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.596 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 120.883 0.373 . . . . 0.0 111.531 179.702 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 4.9 tpp180 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.4 m -86.37 50.56 2.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.489 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER 42.3 52.45 4.58 Favored 'General case' 0 CA--C 1.498 -1.051 0 C-N-CA 123.494 0.717 . . . . 0.0 111.728 176.1 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.9 t70 -46.77 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 O-C-N 125.694 1.871 . . . . 0.0 112.742 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.712 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.5 tmtp? -36.4 -21.16 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 124.212 1.005 . . . . 0.0 112.519 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.77 ' HA ' HG21 ' A' ' 968' ' ' THR . 19.2 m -60.49 -53.84 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 C-N-CA 123.284 0.634 . . . . 0.0 112.364 175.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.415 ' N ' HG23 ' A' ' 925' ' ' VAL . 38.5 t80 -79.77 -37.37 35.5 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 122.084 0.945 . . . . 0.0 108.908 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 930' ' ' THR . 45.7 mt-10 -58.37 -54.84 42.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.703 -178.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.712 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 65.6 t30 -73.68 -33.01 64.24 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -172.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.626 HG12 ' N ' ' A' 1036 ' ' LEU . 21.3 t -63.06 -32.97 58.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.567 172.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.631 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.8 m -61.31 -35.83 78.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 170.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.87 -31.97 69.27 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.18 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.894 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.5 tt -64.12 -38.4 90.92 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 937' ' ' ILE . 22.0 t -69.4 -41.49 80.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.933 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -58.67 -35.29 72.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.177 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.772 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.38 -24.78 42.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.788 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.555 HG12 ' HA ' ' A' ' 933' ' ' VAL . 9.1 p -83.12 -15.39 11.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.406 171.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -68.94 -37.72 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 165.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.744 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.0 mm-40 -52.48 -36.88 55.95 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.744 169.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.538 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.3 tmm? -60.99 -41.92 97.4 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 50.2 m -73.82 -31.26 63.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.735 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 938' ' ' GLU . 22.9 p -77.05 -43.35 34.79 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.686 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.3 mmtp -52.76 -53.24 50.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.187 174.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.838 HG13 ' HE1' ' A' ' 951' ' ' TYR . 14.2 tt -63.58 -23.62 33.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.765 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 73.7 mt-30 -55.39 -62.79 3.84 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.319 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.765 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 44.4 Cg_endo -97.31 25.47 0.24 Allowed 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 121.631 1.554 . . . . 0.0 114.028 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.93 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -113.58 138.8 22.73 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.685 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 69.0 Cg_endo -88.38 -174.07 1.03 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 123.611 2.874 . . . . 0.0 109.972 165.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.782 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 8.1 Cg_endo -51.87 -31.92 44.84 Favored 'Trans proline' 0 C--O 1.247 0.935 0 C-N-CA 122.4 2.067 . . . . 0.0 112.361 176.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.418 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 48.1 mt-10 -52.75 -38.56 61.12 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.775 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.93 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 44.2 mt-10 -104.49 6.42 34.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.838 ' HE1' HG13 ' A' ' 943' ' ' ILE . 5.4 m-30 -66.5 -38.3 86.93 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 170.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.051 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -75.87 -47.72 3.79 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.211 174.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.051 ' HD3' HG12 ' A' ' 952' ' ' VAL . 89.2 Cg_exo -55.28 -26.5 52.5 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.719 1.612 . . . . 0.0 114.943 172.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.622 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 16.8 ptp -73.37 -36.01 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.596 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.964 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -64.08 -27.47 42.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.424 169.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 20.7 ttmm -58.49 -38.45 77.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 175.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.406 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 4.9 mm-40 -57.87 -48.18 80.58 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.271 178.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 6.1 m -73.3 -22.61 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 O-C-N 122.205 -0.31 . . . . 0.0 111.198 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.46 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.29 -44.42 34.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.224 -0.989 . . . . 0.0 111.459 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.28 -26.83 68.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.389 171.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.894 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.28 -54.4 37.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 174.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.589 HD23 HD12 ' A' ' 965' ' ' LEU . 3.4 tm? -62.09 -37.15 83.97 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.401 ' HA ' ' HD3' ' A' ' 963' ' ' ARG . 34.1 mmt180 -56.25 -60.22 3.81 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 172.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 2.1 p -52.79 -40.76 63.5 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.194 0.521 . . . . 0.0 110.211 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.589 HD12 HD23 ' A' ' 962' ' ' LEU . 2.7 tm? -57.05 -35.29 69.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.026 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.441 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 48.6 tp -64.64 -29.04 70.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -178.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.58 96.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.178 0.513 . . . . 0.0 110.097 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.77 HG21 ' HA ' ' A' ' 925' ' ' VAL . 4.5 m -64.24 -35.97 82.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.628 173.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.736 HG12 HD13 ' A' ' 984' ' ' ILE . 83.1 t -54.95 -31.09 24.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.726 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.502 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -74.87 -28.3 60.6 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 120.528 0.204 . . . . 0.0 111.485 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.612 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 23.8 mm-40 -64.79 -53.99 38.25 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 123.027 1.394 . . . . 0.0 108.543 172.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.445 ' HB3' HG23 ' A' 1039 ' ' ILE . 10.4 p -67.24 -22.15 65.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.888 -1.505 . . . . 0.0 111.301 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.699 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 44.6 tp -54.34 -54.67 45.49 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-O 118.938 -0.553 . . . . 0.0 112.127 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.699 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 31.3 Cg_exo -62.39 -25.39 76.22 Favored 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 121.3 1.333 . . . . 0.0 110.941 171.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.55 HG13 ' HB ' ' A' ' 980' ' ' THR . 49.4 t -73.6 -12.88 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.567 174.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.764 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 4.9 tt -74.46 -53.96 3.29 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.557 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.3 Cg_exo -62.36 -22.26 73.84 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.111 1.207 . . . . 0.0 110.693 173.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . 0.527 ' HA ' ' HG3' ' A' 1049 ' ' GLN . . . -70.35 -65.13 0.77 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.101 173.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.753 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.1 m -161.38 -32.76 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.788 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -172.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.66 HG22 ' HA ' ' A' ' 976' ' ' LEU . 1.4 t -66.27 -13.82 61.02 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -173.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.764 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 42.4 t60 -49.83 -21.82 1.26 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.879 0.471 . . . . 0.0 112.097 -174.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.605 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 6.1 ptp180 -78.68 -53.43 7.16 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.024 0.44 . . . . 0.0 110.634 176.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.821 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.2 OUTLIER -77.48 -46.27 23.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -175.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.736 HD13 HG12 ' A' ' 969' ' ' VAL . 11.8 tt -55.45 -34.56 34.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.119 0.485 . . . . 0.0 110.112 -174.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -72.94 -34.26 66.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.305 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 23.1 ptm -66.22 -58.04 6.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.332 -0.547 . . . . 0.0 112.006 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.42 -36.29 33.91 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.404 ' NE2' HG21 ' A' ' 969' ' ' VAL . 6.5 tp60 -67.15 -36.25 81.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.774 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.723 ' HZ2' ' HB2' ' A' ' 989' ' ' LYS . 4.8 ttmp? -66.86 -31.41 71.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.596 0.712 . . . . 0.0 109.123 174.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.45 -39.44 70.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.628 178.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.785 ' HA ' ' OD1' ' A' ' 994' ' ' ASP . 47.3 mt -74.03 -29.12 61.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.299 -176.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -60.95 -43.62 98.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 15.5 m -77.65 -33.85 53.34 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.804 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.785 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p-10 -91.37 -38.07 12.83 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.853 -0.529 . . . . 0.0 111.247 -170.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.513 ' HA ' ' CD1' ' A' 1028 ' ' LEU . 2.7 tm? -59.01 -37.13 76.2 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.562 ' O ' HG22 ' A' ' 999' ' ' ILE . . . -59.93 -51.85 67.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.224 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.645 ' O ' ' HG2' ' A' 1001 ' ' LYS . 2.8 pt-20 -63.7 -35.23 79.88 Favored 'General case' 0 C--O 1.215 -0.731 0 C-N-CA 118.688 -1.205 . . . . 0.0 110.105 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.723 HD13 ' HE3' ' A' 1002 ' ' MET . 1.8 mm? -69.43 -42.34 75.14 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.689 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.801 ' HA ' HG12 ' A' ' 955' ' ' VAL . 17.4 tt -59.65 -25.36 31.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.009 0.433 . . . . 0.0 110.804 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.658 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.0 OUTLIER -104.03 -7.71 20.1 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.987 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.645 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 31.0 mmtp -83.48 -37.69 22.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.964 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 18.9 mmt -72.91 -41.97 64.04 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.8 ttpt -58.13 -48.71 79.38 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 114.275 -1.33 . . . . 0.0 109.639 172.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' 1000 ' ' ASN . 45.7 tp -58.5 -45.74 88.14 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.627 ' HB3' HE22 ' A' 1014 ' ' GLN . . . -63.77 -49.3 73.5 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.372 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.2 pp0? -67.24 -17.64 64.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.901 176.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.729 ' HB2' ' O ' ' A' 1003 ' ' LYS . 6.2 tp-100 -77.77 -33.64 52.65 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.6 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.545 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 17.4 t80 . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.393 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.763 ' HG3' ' HE2' ' A' ' 951' ' ' TYR . 0.6 OUTLIER . . . . . 0 N--CA 1.444 -0.772 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.547 ' O ' ' HG3' ' A' 1019 ' ' LYS . 45.0 mt-30 -59.8 -48.28 82.3 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -156.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -50.88 -52.13 44.83 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 111.309 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.545 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.09 -24.72 61.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.849 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.663 ' HA ' ' HB3' ' A' 1021 ' ' MET . 24.3 tttt -67.92 -31.28 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.655 0.264 . . . . 0.0 110.52 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' 1015 ' ' GLN . 84.1 mttt -61.45 -57.67 11.28 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -50.58 -45.44 57.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.999 172.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.663 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 6.4 ttt -56.41 -54.05 50.14 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.527 0.731 . . . . 0.0 112.0 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.93 -45.22 90.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.644 -175.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 17.0 m -61.22 -32.42 72.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.332 0.587 . . . . 0.0 110.612 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.488 ' O ' HD23 ' A' ' 998' ' ' LEU . . . -78.23 -43.56 28.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.98 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.534 ' CA ' HD12 ' A' ' 998' ' ' LEU . . . -59.1 -31.48 68.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.927 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -70.0 -38.44 75.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.435 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -59.95 -44.11 94.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 174.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.709 ' HA ' ' OD2' ' A' ' 994' ' ' ASP . 1.9 tt -61.76 -54.86 36.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.58 0.705 . . . . 0.0 110.427 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.547 ' HB1' HG21 ' A' ' 936' ' ' VAL . . . -56.49 -36.83 69.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.949 -176.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1030 ' ' VAL . . . . . . . . . . . . . 70.4 t -75.2 -41.68 44.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.808 0.337 . . . . 0.0 110.602 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.461 ' O ' HD21 ' A' ' 991' ' ' LEU . 43.6 m-20 -67.05 -30.0 69.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.537 ' HB3' HD23 ' A' ' 932' ' ' LEU . . . -52.23 -50.91 61.05 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 164.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.513 ' O ' ' HB3' ' A' 1036 ' ' LEU . 58.1 mtmt -64.22 -17.41 63.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.596 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.482 ' O ' HG21 ' A' 1038 ' ' VAL . 59.5 t30 -75.38 -37.3 60.65 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.013 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.686 ' O ' HG13 ' A' 1039 ' ' ILE . 33.3 tp -75.27 -20.44 59.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.626 ' N ' HG12 ' A' ' 929' ' ' VAL . 45.9 tp -57.75 -51.09 71.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.28 174.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -31.46 67.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.728 178.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.821 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 18.6 t -60.69 -62.45 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.005 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.686 HG13 ' O ' ' A' 1035 ' ' LEU . 1.8 mt -77.6 -24.8 14.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.343 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' 1043 ' ' ARG . 18.0 t70 -61.81 -37.88 86.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.798 165.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.703 ' O ' ' HG2' ' A' 1045 ' ' LYS . 13.3 mm100 -70.74 -32.33 69.46 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.076 171.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.542 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.81 -45.3 74.36 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 121.353 0.597 . . . . 0.0 110.081 171.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.58 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.09 -50.19 15.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.127 170.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.508 ' N ' ' HD3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -79.64 -20.88 45.68 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.374 -0.204 . . . . 0.0 111.416 178.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.753 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 38.0 mmtm -65.22 -40.4 94.03 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.67 -44.45 96.45 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.946 -1.024 . . . . 0.0 109.412 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.404 ' HB ' HD21 ' A' 1044 ' ' LEU . 43.8 mm -64.59 -48.22 85.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.442 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -35.28 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.125 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1049 ' ' GLN . . . . . 0.527 ' HG3' ' HA ' ' A' ' 978' ' ' ALA . 1.1 tm0? . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.794 ' HA ' ' HE ' ' A' ' 920' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.734 0.302 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -82.49 47.48 1.17 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.564 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.453 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 46.84 72.03 0.27 Allowed 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.951 0.9 . . . . 0.0 113.035 174.53 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.92 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 1.9 t70 -45.44 -175.5 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 O-C-N 125.624 1.828 . . . . 0.0 112.873 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.1 tmtp? -42.56 -22.66 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.388 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.834 ' HA ' HG21 ' A' ' 968' ' ' THR . 15.5 m -56.64 -51.61 63.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.27 174.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.423 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 5.0 t80 -77.61 -34.43 53.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.179 -1.008 . . . . 0.0 109.348 -175.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -61.68 -49.25 77.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.418 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.431 HD21 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.5 -38.21 77.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.539 -176.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 1.019 ' HA ' HD12 ' A' ' 932' ' ' LEU . 2.9 t -66.0 -29.67 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.846 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.597 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 38.6 m -61.67 -40.28 94.41 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.08 -27.63 60.16 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 114.568 -1.197 . . . . 0.0 113.351 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 1.073 HD13 ' HB2' ' A' ' 965' ' ' LEU . 10.0 mp -64.13 -41.88 97.05 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 117.86 0.83 . . . . 0.0 109.745 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.581 ' O ' HG22 ' A' ' 937' ' ' ILE . 77.9 t -70.59 -35.38 61.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.307 0.575 . . . . 0.0 109.909 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.597 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.2 mmpt? -67.12 -19.14 65.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.168 0.509 . . . . 0.0 109.971 174.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.625 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -83.0 -26.54 31.14 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.653 175.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.54 HG11 ' HA ' ' A' ' 933' ' ' VAL . 8.5 p -88.13 -15.09 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 120.131 -0.627 . . . . 0.0 110.274 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.581 HG22 ' O ' ' A' ' 933' ' ' VAL . 21.0 pt -75.38 -31.84 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 167.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.625 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.9 mm-40 -56.22 -44.84 79.92 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.873 166.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.722 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 26.1 ttt -59.16 -38.98 81.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.726 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.552 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.6 m -67.82 -40.94 83.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.826 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.4 t -76.05 -41.46 50.62 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -175.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.604 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 10.1 mmtm -47.31 -54.03 12.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.876 176.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.616 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 13.6 tt -71.23 -21.51 21.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.548 -174.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.791 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.3 mm-40 -54.74 -63.02 3.24 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 93.4 Cg_endo -98.69 -5.64 0.75 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.699 1.599 . . . . 0.0 114.178 -176.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -111.7 151.63 43.53 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.491 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 90.3 Cg_endo -78.79 -176.61 3.37 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.563 2.842 . . . . 0.0 112.796 -176.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.73 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 75.3 Cg_exo -51.98 -25.75 23.03 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 123.133 2.555 . . . . 0.0 113.35 175.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.411 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 30.1 mm-40 -56.82 -30.7 63.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.829 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.701 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.9 mp0 -97.63 -1.05 44.56 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.641 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.73 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -57.48 -40.69 79.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 170.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.018 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.3 OUTLIER -74.98 -52.45 3.26 Favored Pre-proline 0 CA--C 1.554 1.133 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.115 177.112 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.999 ' HD3' HG12 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.72 -32.33 45.03 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.089 1.859 . . . . 0.0 115.031 172.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.722 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 27.3 ptt? -68.53 -44.54 74.38 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.921 -0.711 . . . . 0.0 110.227 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.678 ' HB ' ' HB3' ' A' 1002 ' ' MET . 70.2 t -66.23 -26.46 38.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.032 170.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 1.6 tmtp? -59.67 -36.99 77.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.2 mm-40 -55.96 -47.35 77.79 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.707 175.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.591 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 3.2 m -73.89 -22.06 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 120.762 0.315 . . . . 0.0 111.241 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.68 -43.47 59.87 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.022 175.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.1 tp -60.29 -23.14 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.345 -0.427 . . . . 0.0 110.512 171.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.848 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.99 -56.36 15.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.776 177.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.715 HD12 HD13 ' A' ' 991' ' ' LEU . 13.9 tp -62.59 -38.67 91.06 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.987 176.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 20.4 tpp180 -51.4 -62.64 1.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 0.0 111.68 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 20.5 p -56.2 -36.82 68.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.841 0.353 . . . . 0.0 110.927 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 1.073 ' HB2' HD13 ' A' ' 932' ' ' LEU . 31.0 tp -58.08 -34.0 69.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.083 176.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 1.096 ' HA ' HG22 ' A' ' 969' ' ' VAL . 4.1 tt -70.32 -24.08 62.95 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.726 -0.389 . . . . 0.0 111.154 -177.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.96 95.87 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 167.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.834 HG21 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -69.36 -42.04 75.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.077 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 1.096 HG22 ' HA ' ' A' ' 966' ' ' LEU . 32.9 m -62.44 -26.34 40.19 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.531 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 18.5 t70 -73.25 -22.9 60.3 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.541 173.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.643 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.6 mm-40 -74.49 -49.94 20.2 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-O 122.113 0.959 . . . . 0.0 109.296 169.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.636 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 93.6 p -63.9 -26.46 68.61 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.929 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 1.076 ' HA ' HD12 ' A' ' 976' ' ' LEU . 0.9 OUTLIER -59.44 -52.26 75.49 Favored Pre-proline 0 N--CA 1.472 0.647 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 52.6 Cg_exo -57.2 -26.02 67.53 Favored 'Trans proline' 0 C--N 1.354 0.859 0 CA-C-N 120.687 1.281 . . . . 0.0 110.392 170.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.755 HG11 ' HB2' ' A' 1046 ' ' MET . 1.8 t -78.79 -18.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.416 175.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 1.076 HD12 ' HA ' ' A' ' 973' ' ' LEU . 8.5 mp -52.66 -58.42 11.99 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 118.147 0.43 . . . . 0.0 110.265 172.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 64.4 Cg_exo -54.81 -38.33 92.11 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 121.839 1.693 . . . . 0.0 111.962 174.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.74 -50.18 74.08 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.111 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.593 ' CB ' ' HG3' ' A' 1045 ' ' LYS . 31.1 t 179.63 -26.43 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.871 0.367 . . . . 0.0 111.287 -179.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.727 ' HG1' ' HB2' ' A' 1042 ' ' ALA . 89.9 m -51.56 -21.0 2.2 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -177.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -52.86 -20.13 3.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.675 0.274 . . . . 0.0 111.358 -177.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -76.83 -51.66 10.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.949 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.904 ' HB2' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -65.7 -54.86 21.62 Favored 'General case' 0 CA--C 1.494 -1.205 0 CA-C-O 122.063 0.935 . . . . 0.0 112.142 178.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.947 HG23 ' HG ' ' A' ' 976' ' ' LEU . 9.2 tp -63.73 -34.15 66.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 113.713 -1.585 . . . . 0.0 110.097 -164.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -60.1 -45.39 93.13 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.966 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.528 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 24.5 ptm -73.61 -52.94 11.69 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.201 -175.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.677 ' HB2' HD23 ' A' 1035 ' ' LEU . . . -78.65 -44.94 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -172.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.688 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.0 OUTLIER -63.44 -44.09 95.54 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.068 -0.253 . . . . 0.0 111.148 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -67.46 -31.92 72.41 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.482 0.658 . . . . 0.0 109.655 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.419 ' HB3' ' O ' ' A' ' 986' ' ' MET . 0.3 OUTLIER -64.52 -50.86 65.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.465 175.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.715 HD13 HD12 ' A' ' 962' ' ' LEU . 3.5 pp -74.2 -27.35 60.76 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.609 -175.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.535 ' N ' HD12 ' A' ' 991' ' ' LEU . 54.6 t30 -58.17 -42.1 85.29 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.438 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 13.5 m -77.82 -28.36 50.23 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.947 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.26 -43.18 8.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -172.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.957 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.88 -44.46 70.47 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 169.336 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.618 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -53.86 -45.76 71.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.258 177.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.696 ' O ' ' HG2' ' A' 1001 ' ' LYS . 22.1 mm-40 -61.36 -34.79 75.88 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 121.676 -0.64 . . . . 0.0 111.675 178.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.657 ' HG ' HD11 ' A' 1028 ' ' LEU . 2.4 mm? -69.31 -34.76 75.16 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.02 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 996' ' ' ALA . 19.9 pt -73.68 -13.36 15.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.938 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.621 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 4.8 p30 -104.15 -3.77 23.99 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.696 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 42.2 mmtm -85.71 -30.61 23.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 170.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.018 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 25.0 ptt? -72.92 -38.1 66.97 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 171.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.779 ' O ' ' HB2' ' A' 1007 ' ' GLN . 17.7 tppt? -63.02 -53.87 47.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.923 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.573 HD11 ' HD3' ' A' 1001 ' ' LYS . 17.1 mt -56.13 -46.81 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.462 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.44 -46.97 88.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.626 0.727 . . . . 0.0 110.373 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.92 -10.36 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.627 0.727 . . . . 0.0 110.03 178.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.779 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -88.74 -27.14 21.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.418 -179.151 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 14.6 t80 . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.58 -179.193 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 120.895 0.379 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.624 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 3.9 pt20 -54.86 -35.26 63.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.064 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.415 ' HA ' ' HE2' ' A' 1019 ' ' LYS . 37.7 tt0 -51.39 -52.56 44.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.826 0.346 . . . . 0.0 111.311 172.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.51 ' CE2' HD22 ' A' 1004 ' ' LEU . 3.2 m-85 -74.99 -21.24 59.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.976 0.417 . . . . 0.0 110.67 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.624 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 81.5 tttt -66.79 -47.0 73.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.452 176.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.415 ' HE2' ' HA ' ' A' 1016 ' ' GLU . 65.6 pttt -73.65 -19.53 60.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.047 0.451 . . . . 0.0 110.719 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.31 -33.3 37.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.54 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 43.5 ttp -71.66 -39.89 70.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.27 174.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.84 -48.86 72.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.151 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -62.17 -33.29 74.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.406 0.622 . . . . 0.0 110.65 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -76.07 -36.2 59.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.884 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.55 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -61.48 -36.5 80.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.493 178.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' 1030 ' ' VAL . 60.2 t60 -63.3 -35.83 81.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.885 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.59 68.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.335 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.957 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.61 -30.66 67.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.281 0.563 . . . . 0.0 110.276 178.003 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.495 ' N ' HD23 ' A' 1028 ' ' LEU . . . -55.84 -40.23 72.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 170.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' 1026 ' ' HIS . 75.1 t -66.95 -33.47 63.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.035 175.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 991' ' ' LEU . 1.2 p30 -70.73 -41.95 71.2 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.295 -177.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.8 66.84 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 171.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 60.1 tttp -59.52 -39.84 85.18 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.737 ' O ' HG22 ' A' 1038 ' ' VAL . 7.5 t30 -68.43 -49.11 62.31 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 121.05 0.453 . . . . 0.0 110.282 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.677 HD23 ' HB2' ' A' ' 987' ' ' ALA . 3.3 tm? -67.54 -36.36 80.84 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.428 ' N ' HG12 ' A' ' 929' ' ' VAL . 5.2 tt -49.19 -44.11 42.79 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.321 0.649 . . . . 0.0 111.812 175.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' 1040 ' ' ASP . 24.3 t70 -89.0 -41.57 12.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.85 -176.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.904 HG12 ' HB2' ' A' ' 983' ' ' GLU . 3.3 t -74.26 -29.42 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.565 ' HA ' ' OE1' ' A' ' 983' ' ' GLU . 1.5 tt -81.14 -31.32 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.401 0.68 . . . . 0.0 110.302 170.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.48 ' HB3' ' O ' ' A' 1037 ' ' ASP . 35.3 t0 -52.78 -38.9 61.75 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 161.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' 1038 ' ' VAL . 48.0 mt-30 -76.27 -25.38 54.87 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.887 174.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.733 ' HB3' ' OE1' ' A' ' 983' ' ' GLU . . . -52.42 -56.31 15.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.709 1.141 . . . . 0.0 110.428 168.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.92 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 2.7 tpt180 -60.66 -29.77 69.48 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.464 178.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.5 tp -78.46 -25.36 45.84 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.37 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.593 ' HG3' ' CB ' ' A' ' 979' ' ' SER . 3.4 mptp? -62.23 -35.98 80.59 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.886 0.875 . . . . 0.0 109.504 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.755 ' HB2' HG11 ' A' ' 975' ' ' VAL . 1.7 tmt? -69.48 -42.31 74.98 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.223 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.464 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.9 mm -60.62 -31.75 49.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.719 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.8 m -64.79 -28.59 69.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.119 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.947 0.403 . . . . 0.0 110.469 178.259 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.79 ' HD2' ' HB2' ' A' 1044 ' ' LEU . 15.0 ttt180 . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 121.089 0.471 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 3.0 t -111.31 29.27 7.96 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.444 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 48.27 59.45 4.28 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.738 -175.422 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.0 t70 -47.33 -173.54 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 O-C-N 125.631 1.832 . . . . 0.0 112.363 -176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.509 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.3 tmtp? -37.78 -25.05 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.374 1.07 . . . . 0.0 112.067 -177.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.731 ' HB ' HG13 ' A' 1039 ' ' ILE . 10.3 m -59.9 -49.79 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.059 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.63 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 62.2 t80 -75.93 -40.3 54.42 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.208 -178.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.96 -47.88 84.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.225 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.509 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.4 t-20 -72.18 -42.93 65.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.786 -173.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.647 ' CG2' HD11 ' A' 1039 ' ' ILE . 47.1 t -65.02 -30.17 49.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.676 178.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 51.8 m -60.85 -32.53 71.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.87 74.18 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.323 -1.308 . . . . 0.0 113.264 173.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.849 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.1 tt -61.78 -44.05 97.63 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 118.42 1.11 . . . . 0.0 108.314 175.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 937' ' ' ILE . 43.4 t -55.79 -44.1 76.26 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.549 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.1 mmpt? -61.58 -38.21 86.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' ' 961' ' ' ALA . . . -80.55 -25.58 38.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.893 -177.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.576 ' HA ' HG21 ' A' ' 958' ' ' VAL . 14.1 p -80.28 -15.58 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 C-N-CA 119.726 -0.789 . . . . 0.0 109.057 170.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 933' ' ' VAL . 20.5 mm -71.46 -35.37 56.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 166.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 70.4 mm-40 -52.85 -42.4 65.18 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.824 169.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.548 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 35.7 ttp -57.65 -46.69 83.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.485 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.4 p -72.75 -26.75 61.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.914 0.388 . . . . 0.0 110.979 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.488 ' HA ' ' NE2' ' A' ' 944' ' ' GLN . 20.2 m -78.82 -43.34 25.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.66 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.7 mmtp -54.58 -49.66 69.86 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.209 -1.814 . . . . 0.0 111.193 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.837 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.6 tt -65.57 -28.69 44.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 123.137 0.273 . . . . 0.0 111.599 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.758 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 69.1 mt-30 -50.06 -61.11 4.02 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.758 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 64.1 Cg_endo -97.78 16.73 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.562 1.508 . . . . 0.0 113.821 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.824 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -100.86 148.58 35.24 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -173.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.559 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 79.6 Cg_endo -86.4 -178.68 2.82 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.433 2.755 . . . . 0.0 110.231 165.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.861 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 10.0 Cg_endo -51.62 -34.63 53.78 Favored 'Trans proline' 0 C--O 1.249 1.057 0 C-N-CA 122.648 2.232 . . . . 0.0 112.73 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.507 ' O ' ' HD2' ' A' ' 953' ' ' PRO . 25.0 mt-10 -54.0 -39.05 65.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.018 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 1.3 mp0 -95.83 2.42 53.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.861 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 21.0 m-30 -65.7 -38.56 89.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 172.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.929 HG11 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.34 -55.47 6.05 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 119.536 -0.866 . . . . 0.0 111.511 174.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.929 ' HD3' HG11 ' A' ' 952' ' ' VAL . 75.2 Cg_exo -51.02 -32.07 37.29 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 122.124 1.883 . . . . 0.0 115.166 173.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.837 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.9 ptt? -65.93 -45.18 82.8 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 121.502 -0.749 . . . . 0.0 110.157 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.693 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.8 t -69.94 -25.52 28.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.202 0.525 . . . . 0.0 110.022 173.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.532 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 61.0 tttm -61.2 -37.93 84.75 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.7 mm-40 -54.23 -44.61 71.87 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.494 172.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.664 HG22 ' HA ' ' A' ' 955' ' ' VAL . 2.7 t -65.57 -28.64 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.497 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.543 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -71.72 -43.45 51.32 Favored Glycine 0 C--N 1.328 0.131 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.561 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -32.28 73.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.849 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -54.3 -56.13 21.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.012 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.719 HD11 HD11 ' A' ' 991' ' ' LEU . 61.1 tp -66.53 -36.47 82.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -58.11 -49.68 76.11 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.741 -0.599 . . . . 0.0 110.71 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 26.8 m -53.69 -35.78 61.47 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.124 173.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.689 HD12 ' HB2' ' A' ' 932' ' ' LEU . 7.2 mt -66.02 -38.03 87.41 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 120.847 0.356 . . . . 0.0 110.134 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.17 -32.65 37.04 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.203 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.41 -47.63 63.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.467 HG21 ' O ' ' A' ' 965' ' ' LEU . 6.8 t -69.56 -32.35 71.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.314 0.578 . . . . 0.0 110.109 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.893 HG13 HD13 ' A' ' 984' ' ' ILE . 45.5 t -55.5 -32.5 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.126 169.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.713 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 27.6 t70 -71.08 -25.38 62.6 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 120.636 0.255 . . . . 0.0 110.875 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.445 ' O ' HG23 ' A' ' 975' ' ' VAL . 5.4 mm-40 -65.52 -49.69 68.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.984 1.373 . . . . 0.0 108.408 169.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.581 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.2 t -65.87 -24.28 66.83 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 113.834 -1.53 . . . . 0.0 111.766 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.703 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.2 OUTLIER -61.58 -53.21 63.61 Favored Pre-proline 0 C--O 1.215 -0.761 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.791 -176.496 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.713 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 6.9 Cg_endo -54.77 -28.44 57.48 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 121.497 1.57 . . . . 0.0 111.584 168.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.71 -11.59 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.881 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.904 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -67.58 -51.97 29.2 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-O 118.965 -0.541 . . . . 0.0 111.316 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.575 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 32.5 Cg_exo -60.83 -33.01 93.37 Favored 'Trans proline' 0 C--N 1.363 1.297 0 C-N-CA 121.503 1.468 . . . . 0.0 110.715 173.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -60.13 -54.89 40.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.873 175.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.813 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -168.74 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.765 HG22 ' HB ' ' A' ' 984' ' ' ILE . 17.4 m -52.46 -20.2 2.72 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -170.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.904 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 19.1 p-80 -49.66 -22.19 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -171.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.24 -54.78 11.3 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.299 178.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.876 ' HB3' HG21 ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.14 -41.82 40.3 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 179.372 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.893 HD13 HG13 ' A' ' 969' ' ' VAL . 10.8 tp -60.87 -30.6 47.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.395 -171.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.87 -42.82 60.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.173 174.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.623 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 18.1 ptp -64.34 -52.83 56.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -173.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.831 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -75.94 -35.57 59.66 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.61 -174.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.565 ' NE2' HG13 ' A' ' 984' ' ' ILE . 32.9 mt-30 -57.97 -54.98 40.83 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.815 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -57.89 -36.6 72.64 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.802 0.81 . . . . 0.0 109.454 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.587 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 14.0 tp -60.63 -62.06 2.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.963 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.978 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 1.3 pp -73.1 -23.23 60.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -172.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.48 ' N ' HD13 ' A' ' 991' ' ' LEU . 24.2 t-20 -64.69 -35.66 81.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 23.7 m -76.04 -36.83 58.93 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.886 -178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.05 -32.77 13.66 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.323 -171.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.969 ' HA ' HD13 ' A' 1028 ' ' LEU . 1.7 tm? -58.46 -38.0 76.62 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.46 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -67.72 -41.17 83.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.629 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 6.9 mm-40 -53.61 -44.3 69.34 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.3 172.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.559 ' HB3' HG12 ' A' ' 955' ' ' VAL . 4.2 mm? -69.56 -29.31 66.84 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.981 178.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.707 ' O ' ' HG2' ' A' 1002 ' ' MET . 43.8 mt -61.14 -45.5 98.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 174.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.629 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 2.9 p30 -82.91 -15.26 52.1 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.985 -0.447 . . . . 0.0 111.292 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.61 ' HA ' ' CB ' ' A' 1004 ' ' LEU . 66.1 mttm -86.37 -26.58 24.74 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.478 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.87 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 21.1 ptt? -73.93 -34.24 64.26 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.918 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.6 ttpt -73.91 -18.03 60.96 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 113.324 -1.762 . . . . 0.0 109.573 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.61 ' CB ' ' HA ' ' A' 1001 ' ' LYS . 35.9 tp -85.84 -54.72 4.34 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.178 0.924 . . . . 0.0 110.646 -173.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.22 -38.62 83.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.263 0.554 . . . . 0.0 109.848 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -23.92 54.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.059 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.918 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.9 tp-100 -69.89 -42.16 73.79 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.355 0.598 . . . . 0.0 109.75 177.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.635 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.483 177.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.441 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? . . . . . 0 C--O 1.233 0.23 0 CA-C-O 120.492 0.187 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.5 -37.06 74.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.561 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -50.09 -39.84 43.74 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.775 0.321 . . . . 0.0 111.673 173.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.635 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 5.6 m-30 -84.89 -24.0 28.68 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.831 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.664 ' HA ' ' HE1' ' A' 1021 ' ' MET . 76.1 tttt -69.74 -44.47 70.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.826 0.346 . . . . 0.0 110.401 174.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -57.95 -57.47 12.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.475 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -57.04 -37.21 71.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.71 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.664 ' HE1' ' HA ' ' A' 1018 ' ' LYS . 40.5 ttp -64.73 -42.15 95.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.802 0.335 . . . . 0.0 110.934 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.1 tp -66.06 -41.7 90.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.943 0.402 . . . . 0.0 110.72 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 4.5 m -65.42 -30.08 70.85 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.856 0.836 . . . . 0.0 109.99 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.436 ' C ' HD22 ' A' ' 998' ' ' LEU . . . -78.91 -40.08 33.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.695 -1.138 . . . . 0.0 109.91 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.518 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.629 ' O ' HG21 ' A' 1030 ' ' VAL . 15.2 t-80 -65.13 -38.22 89.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.81 -46.79 74.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.209 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.969 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.87 -32.58 73.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 109.988 179.566 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.611 ' N ' HD21 ' A' 1028 ' ' LEU . . . -60.52 -33.96 73.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.475 170.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.629 HG21 ' O ' ' A' 1026 ' ' HIS . 85.9 t -75.82 -32.45 23.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 109.828 177.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.978 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 7.5 m-20 -59.34 -44.43 92.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.237 172.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.557 ' HB2' HD11 ' A' ' 932' ' ' LEU . . . -58.2 -52.97 63.34 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.793 170.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.526 ' O ' ' HG ' ' A' 1036 ' ' LEU . 1.6 tmtp? -53.47 -38.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.276 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.605 ' O ' HG22 ' A' 1038 ' ' VAL . 66.5 t30 -71.88 -39.89 69.31 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.911 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.772 HD21 HD23 ' A' ' 991' ' ' LEU . 17.1 tp -74.23 -29.52 61.74 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 121.279 -0.168 . . . . 0.0 110.657 -176.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.637 ' HB3' ' CG1' ' A' ' 929' ' ' VAL . 4.7 pp -70.5 -26.66 63.7 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.35 -39.68 38.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 174.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.876 HG21 ' HB3' ' A' ' 983' ' ' GLU . 19.5 t -51.77 -56.15 6.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.163 174.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.731 HG13 ' HB ' ' A' ' 925' ' ' VAL . 20.5 pt -94.24 -26.48 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -170.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.63 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 2.8 t0 -55.25 -42.63 73.72 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.511 162.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.673 ' O ' ' HG2' ' A' 1045 ' ' LYS . 21.8 mt-30 -77.61 -22.67 50.45 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.676 175.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.698 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.52 -50.79 64.69 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.055 0.455 . . . . 0.0 110.463 169.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.666 ' HG2' HG22 ' A' ' 925' ' ' VAL . 16.8 mmt180 -54.73 -38.12 66.74 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.093 0.473 . . . . 0.0 110.434 172.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.79 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 56.9 tp -69.48 -28.39 66.04 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.286 174.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.813 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 24.5 mmtp -67.84 -40.9 83.66 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.861 0.839 . . . . 0.0 109.133 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 26.6 ttt -59.23 -46.44 88.47 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.161 -1.381 . . . . 0.0 108.889 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.9 -50.8 78.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.011 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.1 m -41.84 -47.96 4.28 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.3 tt0 . . . . . 0 C--N 1.327 -0.409 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.744 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.714 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 8.4 tpt180 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 22.7 t 76.88 26.96 0.75 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.393 0.616 . . . . 0.0 110.054 -173.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.484 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 46.93 69.79 0.46 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.706 168.635 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.734 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.5 t70 -47.05 -174.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.648 -1.615 . . . . 0.0 112.67 -178.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.454 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 1.2 tmtp? -40.12 -23.05 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.998 0.919 . . . . 0.0 112.169 -177.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.661 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 7.5 m -56.36 -50.28 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 172.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.484 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 7.6 t80 -75.08 -29.75 60.76 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.011 0.91 . . . . 0.0 108.8 -176.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.37 -56.22 9.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.615 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -38.75 76.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.677 -175.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.924 ' HB ' HD12 ' A' 1039 ' ' ILE . 9.5 p -60.41 -34.13 56.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.904 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 93.4 m -69.1 -35.66 76.71 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.47 -28.03 61.7 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.618 174.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.913 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 5.1 tt -66.83 -46.8 73.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.599 ' O ' HG21 ' A' ' 937' ' ' ILE . 17.7 t -59.59 -39.85 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.165 176.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.636 ' O ' HG12 ' A' ' 937' ' ' ILE . 10.0 mmpt? -70.3 -19.03 63.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.102 0.477 . . . . 0.0 110.435 177.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.693 ' CB ' ' HB3' ' A' ' 961' ' ' ALA . . . -82.63 -25.33 33.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.92 0.39 . . . . 0.0 110.623 175.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.6 ' HB ' HG23 ' A' ' 958' ' ' VAL . 11.1 p -86.41 -10.09 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.927 172.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.636 HG12 ' O ' ' A' ' 934' ' ' LYS . 5.6 pt -83.48 -27.24 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 165.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.63 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.3 mt-10 -57.64 -39.29 76.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 164.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.605 ' HG2' ' SD ' ' A' ' 954' ' ' MET . 1.7 tmt? -57.07 -45.6 83.13 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.054 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.627 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 21.0 m -67.65 -30.06 69.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.99 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 20.1 m -79.62 -46.67 16.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.995 0.902 . . . . 0.0 108.677 -175.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.554 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 3.3 tmtm? -56.86 -45.61 82.35 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.366 -1.743 . . . . 0.0 110.786 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.882 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.1 tt -67.69 -30.34 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 O-C-N 123.302 0.376 . . . . 0.0 111.772 -176.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.4 mt-30 -50.09 -60.01 5.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.762 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 77.5 Cg_endo -97.37 34.8 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.513 1.475 . . . . 0.0 112.935 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.71 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -120.43 141.37 31.88 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.56 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 86.7 Cg_endo -88.7 -179.33 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 123.19 2.593 . . . . 0.0 109.718 165.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.631 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 9.1 Cg_endo -50.87 -32.37 37.24 Favored 'Trans proline' 0 C--O 1.247 0.932 0 C-N-CA 122.5 2.134 . . . . 0.0 112.451 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.6 -43.7 72.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.962 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.71 ' HB2' ' HB2' ' A' ' 946' ' ' ALA . 2.8 mp0 -95.71 1.72 53.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.537 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.631 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 5.9 m-30 -61.01 -48.25 82.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.519 -0.473 . . . . 0.0 109.786 176.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.006 HG12 ' HD3' ' A' ' 953' ' ' PRO . 1.3 p -75.72 -42.71 3.86 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.294 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.006 ' HD3' HG12 ' A' ' 952' ' ' VAL . 84.5 Cg_exo -52.68 -30.69 47.08 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.459 2.106 . . . . 0.0 113.753 168.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.882 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 33.8 ttp -56.88 -54.13 50.03 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 122.119 0.962 . . . . 0.0 109.189 174.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.527 HG12 ' HA ' ' A' ' 999' ' ' ILE . 42.0 t -60.64 -28.17 42.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.33 172.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 82.0 tttt -59.37 -38.28 80.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.474 ' OE1' ' HB3' ' A' ' 938' ' ' GLU . 38.9 mt-10 -59.11 -46.0 89.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.248 176.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.803 HG23 HD21 ' A' 1028 ' ' LEU . 10.0 p -75.11 -22.08 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 120.116 -0.633 . . . . 0.0 111.416 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.413 ' HA2' ' CD1' ' A' ' 995' ' ' LEU . . . -71.89 -43.83 48.72 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.646 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.78 -23.69 65.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.025 0.44 . . . . 0.0 110.732 172.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.913 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -60.42 -55.67 30.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.846 175.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.552 ' CD1' HD11 ' A' ' 991' ' ' LEU . 35.0 tp -64.37 -35.02 79.52 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.165 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 10.2 tpt180 -55.07 -57.73 10.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.187 0.518 . . . . 0.0 111.195 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 12.7 m -57.34 -38.14 73.65 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 110.646 175.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.776 HD22 HD22 ' A' 1035 ' ' LEU . 56.1 tp -64.64 -28.07 69.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.069 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.433 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 54.2 tp -62.29 -33.19 74.18 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.69 93.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.198 0.523 . . . . 0.0 110.034 172.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.661 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.8 m -67.59 -37.91 83.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.882 173.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 965' ' ' LEU . 93.8 t -56.47 -30.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.204 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.582 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.4 t70 -77.64 -22.29 50.93 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.429 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.624 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 41.8 mm-40 -71.82 -50.41 29.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 122.718 1.247 . . . . 0.0 108.499 170.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.626 ' OG ' HG23 ' A' ' 980' ' ' THR . 47.8 t -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.685 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.734 ' HA ' HD22 ' A' ' 976' ' ' LEU . 7.4 tt -60.87 -54.39 54.86 Favored Pre-proline 0 C--O 1.213 -0.827 0 CA-C-O 118.445 -0.788 . . . . 0.0 112.156 -176.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 38.0 Cg_exo -59.5 -27.49 85.09 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 121.613 1.612 . . . . 0.0 110.486 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.1 t -75.72 -14.2 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.982 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.939 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.6 pp -76.81 -41.98 2.77 Favored Pre-proline 0 CA--C 1.539 0.529 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.762 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.939 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 17.2 Cg_exo -69.03 -28.98 28.09 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.068 1.417 . . . . 0.0 110.118 172.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.32 -55.75 28.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.23 171.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.78 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 38.6 m -162.7 -42.04 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.836 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 93.6 m -51.53 -26.99 9.52 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -171.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.655 ' HA ' HG23 ' A' ' 984' ' ' ILE . 11.6 p80 -50.97 -39.12 54.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.1 0.864 . . . . 0.0 112.723 -165.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.4 mtm180 -53.73 -50.85 65.04 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.537 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.837 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.7 -48.35 32.73 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.841 -178.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.655 HG23 ' HA ' ' A' ' 981' ' ' HIS . 9.7 tp -60.4 -30.2 45.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.162 -174.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.65 -35.86 75.57 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.027 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.653 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 15.6 ptm -66.78 -52.69 41.12 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.455 -176.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.888 ' HB1' HG22 ' A' 1038 ' ' VAL . . . -80.41 -44.75 18.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -174.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.483 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -64.24 -35.29 80.32 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.033 -173.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -66.11 -42.49 89.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.415 0.626 . . . . 0.0 109.515 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -49.56 75.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.261 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.64 HD21 HD21 ' A' 1035 ' ' LEU . 2.4 pp -73.92 -29.39 62.02 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -173.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.535 ' N ' HD13 ' A' ' 991' ' ' LEU . 6.8 t30 -57.81 -43.34 85.65 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 m -76.6 -25.21 53.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.92 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -101.29 -45.56 5.3 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -172.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.931 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.31 -52.7 62.6 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.334 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.53 -43.99 80.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.517 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' 1001 ' ' LYS . 62.1 tt0 -54.23 -41.06 68.27 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.548 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.625 HD12 ' HB3' ' A' 1001 ' ' LYS . 46.0 tp -70.05 -31.22 68.73 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.693 -175.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.655 ' O ' ' HB2' ' A' 1003 ' ' LYS . 59.3 mt -58.96 -35.05 54.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.332 0.586 . . . . 0.0 109.862 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.446 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 35.5 m-80 -95.66 -10.16 30.12 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.771 178.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.625 ' HB3' HD12 ' A' ' 998' ' ' LEU . 27.1 tptt -82.75 -48.4 10.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.598 ' HE3' ' CG ' ' A' ' 951' ' ' TYR . 7.8 tpt -79.58 -26.39 41.32 Favored 'General case' 0 N--CA 1.438 -1.037 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.223 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.716 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.5 tttm -56.16 -48.96 75.31 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 168.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.444 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 31.7 tp -58.31 -43.73 88.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.351 174.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -64.16 -42.08 96.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.05 0.452 . . . . 0.0 110.926 178.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.54 -12.54 60.04 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.218 177.231 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.716 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.3 tp-100 -85.09 -23.27 28.57 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.563 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.477 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.042 176.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.461 0.103 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -60.3 -37.4 80.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.809 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.45 ' O ' ' HG3' ' A' 1020 ' ' GLN . 15.0 tp10 -50.78 -50.38 56.19 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.673 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.477 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.32 -25.57 61.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.792 0.33 . . . . 0.0 111.445 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' 1021 ' ' MET . 62.1 tttm -70.2 -36.04 74.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.319 0.581 . . . . 0.0 109.848 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 78.2 tttt -65.82 -29.75 70.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.267 174.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' 1016 ' ' GLU . 79.1 mt-30 -83.84 -38.33 21.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.992 -176.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -71.59 -25.94 62.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.854 177.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.9 tm? -64.82 -42.18 95.17 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 16.7 m -58.91 -35.55 73.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.452 176.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -79.06 -38.82 35.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.441 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -61.69 -32.65 72.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.098 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.495 ' O ' HG21 ' A' 1030 ' ' VAL . 77.9 t60 -72.9 -40.89 65.18 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.151 176.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.28 -37.6 87.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.204 0.526 . . . . 0.0 109.851 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.931 HD11 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -60.2 -50.33 74.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.583 173.568 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.11 70.38 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.374 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.495 HG21 ' O ' ' A' 1026 ' ' HIS . 97.5 t -65.75 -33.15 61.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.671 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.81 -39.32 73.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.857 -0.737 . . . . 0.0 109.948 -177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.766 ' HB2' HD23 ' A' ' 932' ' ' LEU . . . -62.15 -53.69 51.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.54 170.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.808 ' HA ' HD22 ' A' 1036 ' ' LEU . 96.9 mttt -63.77 -32.47 73.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -175.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.545 ' O ' HG21 ' A' 1038 ' ' VAL . 7.0 t30 -69.79 -36.88 76.07 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.006 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.776 HD22 HD22 ' A' ' 965' ' ' LEU . 13.6 tp -77.65 -24.17 49.51 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.486 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.833 ' HA ' HG13 ' A' ' 929' ' ' VAL . 0.5 OUTLIER -59.42 -43.76 93.0 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' 1041 ' ' GLN . 33.6 t70 -73.94 -22.6 59.6 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.217 177.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.888 HG22 ' HB1' ' A' ' 987' ' ' ALA . 15.1 t -76.89 -46.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.855 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.924 HD12 ' HB ' ' A' ' 929' ' ' VAL . 8.0 pt -92.62 -31.69 4.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -175.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.559 ' HB3' ' O ' ' A' 1036 ' ' LEU . 0.5 OUTLIER -54.1 -48.43 70.71 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 163.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.625 ' O ' ' HG2' ' A' 1045 ' ' LYS . 25.1 mt-30 -75.37 -22.33 57.6 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 115.063 -0.972 . . . . 0.0 111.201 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.712 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.4 -52.75 62.53 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.382 0.611 . . . . 0.0 110.255 165.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.734 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 1.2 mpt_? -59.39 -28.26 66.73 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.74 173.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.622 ' HB2' ' HA ' ' A' 1041 ' ' GLN . 84.0 mt -78.76 -23.37 45.38 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.108 173.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.836 ' HG3' ' HA ' ' A' ' 980' ' ' THR . 48.6 mmtm -63.28 -36.21 82.93 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 2.0 tmt? -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.268 176.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.5 -38.93 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.685 172.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.7 m -64.53 -41.45 96.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.601 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.057 -178.691 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.561 ' HB2' ' CG1' ' A' 1047 ' ' ILE . 3.8 tpt180 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 29.9 m -85.49 27.62 0.82 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.629 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.61 68.76 0.78 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.862 0.865 . . . . 0.0 112.148 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.732 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.3 t70 -47.68 -171.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.497 -2.138 . . . . 0.0 112.511 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.592 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.0 tmtm? -27.92 -26.9 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.16 1.384 . . . . 0.0 113.8 177.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.842 HG22 ' HB2' ' A' 1043 ' ' ARG . 3.9 m -57.33 -52.65 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 174.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -77.28 -26.21 52.15 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 34.0 mt-10 -66.79 -62.28 1.53 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.761 -1.108 . . . . 0.0 112.097 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.471 ' HB2' ' CD ' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.91 -32.53 67.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.788 -0.187 . . . . 0.0 111.141 -172.452 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.913 ' HB ' HD11 ' A' 1039 ' ' ILE . 10.7 p -61.38 -31.76 51.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.888 175.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.573 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.6 m -63.46 -38.08 89.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 169.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . 0.455 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -59.09 -27.63 62.78 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.865 173.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.923 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 15.7 tp -66.03 -34.35 77.88 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 937' ' ' ILE . 57.7 t -77.01 -37.7 26.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.293 173.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.5 mmpt? -58.85 -37.57 76.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.155 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 1.08 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . . . -80.1 -24.64 40.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.708 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.553 HG13 ' HA ' ' A' ' 933' ' ' VAL . 14.5 p -79.47 -15.33 13.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.045 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.594 HG12 ' O ' ' A' ' 933' ' ' VAL . 44.1 mm -74.62 -38.53 45.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 165.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.656 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 19.2 mm-40 -52.45 -46.28 66.39 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 167.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.982 ' HG2' ' HE1' ' A' ' 954' ' ' MET . 29.3 ttp -58.32 -37.0 74.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.667 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.582 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 46.1 m -74.29 -37.96 63.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.625 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.472 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 28.3 m -78.82 -44.27 23.43 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.979 0.895 . . . . 0.0 109.452 -175.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.692 ' HD2' ' HB2' ' A' ' 954' ' ' MET . 4.5 tmtm? -59.89 -34.75 73.58 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.383 -178.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.654 ' HB ' ' HE2' ' A' ' 954' ' ' MET . 7.6 tt -77.35 -24.99 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 O-C-N 123.0 0.187 . . . . 0.0 111.143 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.728 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 87.1 mm-40 -51.39 -55.65 27.18 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.575 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.728 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.8 Cg_endo -99.89 31.59 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.148 1.899 . . . . 0.0 112.697 175.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.679 ' HB1' ' O ' ' A' ' 942' ' ' LYS . . . -102.87 126.27 33.09 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -172.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.413 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 67.7 Cg_endo -77.26 171.88 17.0 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.75 2.3 . . . . 0.0 109.298 160.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.524 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 6.3 Cg_endo -50.01 -38.71 49.76 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 122.581 2.188 . . . . 0.0 112.689 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.06 -23.95 65.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.682 ' HB3' ' HE3' ' A' ' 942' ' ' LYS . 20.4 mm-40 -102.39 -15.66 16.46 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.327 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.709 ' HB2' ' HG3' ' A' 1006 ' ' GLN . 26.8 m-85 -55.03 -51.44 66.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.295 0.569 . . . . 0.0 109.644 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.052 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -66.91 -42.75 44.69 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.728 -178.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.052 ' HD3' HG12 ' A' ' 952' ' ' VAL . 73.8 Cg_exo -58.26 -35.1 99.04 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 121.639 1.559 . . . . 0.0 113.555 168.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.982 ' HE1' ' HG2' ' A' ' 939' ' ' MET . 0.3 OUTLIER -62.44 -50.19 72.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.865 0.84 . . . . 0.0 109.737 177.492 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.604 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -60.41 -26.32 36.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.22 172.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.862 ' HB3' ' HZ2' ' A' ' 956' ' ' LYS . 2.6 ttpm? -66.37 -35.16 79.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.51 -46.73 80.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.049 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 961' ' ' ALA . 12.2 p -69.71 -22.64 25.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.957 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.24 -43.31 71.7 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.116 -1.04 . . . . 0.0 111.507 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.83 -22.2 65.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 111.067 172.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 1.08 ' HB1' ' HB3' ' A' ' 935' ' ' ALA . . . -63.47 -57.63 9.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.251 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.77 HD12 HD12 ' A' ' 965' ' ' LEU . 16.9 tp -68.82 -32.55 72.33 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.495 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -57.48 -60.5 3.55 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.419 HG23 ' OD1' ' A' ' 928' ' ' ASN . 22.5 m -55.31 -34.8 64.48 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.848 0.832 . . . . 0.0 110.293 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.77 HD12 HD12 ' A' ' 962' ' ' LEU . 2.6 tm? -64.52 -28.73 69.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.577 176.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 85.8 mt -67.5 -28.96 68.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.612 0.244 . . . . 0.0 110.654 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.56 -42.91 98.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.439 0.638 . . . . 0.0 109.497 172.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.774 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.8 m -62.36 -40.04 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.927 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.813 HG13 HD13 ' A' ' 984' ' ' ILE . 54.4 t -55.62 -31.26 28.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.197 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.534 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.0 t70 -74.46 -22.42 59.11 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.636 0.255 . . . . 0.0 110.97 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.632 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 59.6 mm-40 -71.95 -46.53 57.12 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 122.635 1.207 . . . . 0.0 109.317 169.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.727 ' HG ' HG23 ' A' ' 980' ' ' THR . 28.5 t -66.32 -24.64 66.57 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.59 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.0 tp -60.57 -50.14 86.81 Favored Pre-proline 0 C--O 1.22 -0.498 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.248 -177.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.632 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.6 Cg_exo -58.12 -28.27 83.06 Favored 'Trans proline' 0 C--N 1.358 1.062 0 CA-C-N 121.02 1.4 . . . . 0.0 110.868 169.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.6 HG11 ' O ' ' A' 1042 ' ' ALA . 40.9 t -74.45 -15.76 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.547 176.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.76 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 2.2 tt -67.92 -52.72 23.24 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.157 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 35.8 Cg_exo -61.62 -29.07 83.52 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.155 1.237 . . . . 0.0 110.719 172.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -66.52 -59.39 3.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.392 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.55 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 68.8 m -163.9 -39.03 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -173.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.727 HG23 ' HG ' ' A' ' 972' ' ' SER . 2.0 t -62.11 -16.14 50.36 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -169.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.76 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 35.7 t60 -48.44 -21.55 0.57 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.806 0.443 . . . . 0.0 112.073 -177.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 11.1 tpp180 -77.66 -54.36 6.47 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.324 0.583 . . . . 0.0 110.379 176.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.918 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.65 -46.54 25.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.312 -176.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.813 HD13 HG13 ' A' ' 969' ' ' VAL . 12.6 tt -57.8 -32.96 44.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.228 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.58 -35.26 67.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.363 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.698 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.1 ptp -61.53 -61.5 2.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.746 -176.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.721 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.42 -34.94 31.24 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.491 ' NE2' HG11 ' A' ' 969' ' ' VAL . 45.2 tt0 -64.05 -47.76 78.91 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.59 0.632 . . . . 0.0 111.25 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -68.56 -27.9 66.48 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.505 HD23 ' OD1' ' A' 1031 ' ' ASP . 7.3 tp -63.65 -42.99 98.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.857 176.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 92.6 mt -68.13 -31.29 70.78 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.035 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -56.4 -47.18 79.51 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -31.42 58.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.715 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.563 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.7 p30 -91.37 -52.09 4.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 120.069 -0.652 . . . . 0.0 112.435 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.049 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.05 -52.03 59.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.7 87.78 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.18 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.549 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 7.8 pt-20 -65.11 -32.6 74.38 Favored 'General case' 0 C--O 1.212 -0.909 0 C-N-CA 119.164 -1.015 . . . . 0.0 110.581 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.674 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 3.0 mm? -66.38 -41.86 88.77 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.647 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.504 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.3 mt -52.99 -40.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.981 173.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.509 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 51.3 m-20 -88.41 -10.07 50.49 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.343 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -85.77 -39.26 17.32 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.786 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.693 ' SD ' ' HD2' ' A' ' 951' ' ' TYR . 0.1 OUTLIER -78.72 -36.57 43.16 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 174.601 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.703 ' O ' ' HB2' ' A' 1007 ' ' GLN . 76.0 tttt -60.48 -52.48 65.02 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.139 173.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.431 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 13.7 mt -57.47 -41.17 80.11 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 174.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.799 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -61.62 -45.8 92.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 0.0 110.496 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.709 ' HG3' ' HB2' ' A' ' 951' ' ' TYR . 11.7 mm-40 -77.63 -9.55 59.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.733 0.778 . . . . 0.0 110.34 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.703 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.4 OUTLIER -87.55 -5.31 58.82 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.256 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 79.5 t80 . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.784 179.605 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.463 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -60.88 -37.73 83.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.482 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -49.88 -50.03 47.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 173.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.799 ' HD2' ' HA ' ' A' 1005 ' ' ALA . 1.1 m-30 -71.04 -28.15 64.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.559 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.463 ' HB2' HE22 ' A' 1014 ' ' GLN . 28.8 ttpp -74.86 -25.12 58.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.207 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 46.4 tttp -65.86 -61.0 2.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.173 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.03 -41.83 26.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.759 168.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.498 ' HG3' ' HE2' ' A' 1002 ' ' MET . 1.8 tmt? -63.42 -44.64 94.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.837 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 50.8 tp -60.5 -37.66 81.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.779 0.324 . . . . 0.0 111.42 -177.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 25.9 m -68.93 -31.77 70.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.573 0.702 . . . . 0.0 110.15 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -79.25 -39.26 33.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.86 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.55 ' HB1' ' HE3' ' A' ' 939' ' ' MET . . . -63.84 -36.28 83.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.758 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.512 ' O ' HG21 ' A' 1030 ' ' VAL . 63.6 t60 -66.52 -31.16 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.493 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.94 -50.54 55.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.375 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 1.049 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.97 -32.07 73.07 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.15 0.5 . . . . 0.0 109.755 -175.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.625 ' N ' HD21 ' A' 1028 ' ' LEU . . . -61.69 -44.84 96.17 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.091 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' 1026 ' ' HIS . 64.5 t -77.25 -18.99 14.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.535 ' C ' HD23 ' A' ' 991' ' ' LEU . 69.3 m-20 -85.73 -34.42 21.23 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.702 176.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.649 ' HB2' ' HG ' ' A' ' 932' ' ' LEU . . . -53.83 -49.14 69.06 Favored 'General case' 0 C--N 1.345 0.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 161.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.748 ' O ' ' HG ' ' A' 1036 ' ' LEU . 56.8 tttm -61.14 -28.38 69.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.638 177.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.582 ' O ' HG22 ' A' 1038 ' ' VAL . 67.2 t30 -74.74 -34.32 62.5 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.9 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.695 ' CD2' HD11 ' A' ' 965' ' ' LEU . 25.1 tp -78.09 -23.69 47.86 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.688 -177.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.878 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.2 pp -63.6 -43.27 97.39 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.415 ' N ' HD12 ' A' 1036 ' ' LEU . 16.5 t70 -62.68 -43.73 98.05 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.101 175.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.918 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 44.2 t -53.4 -69.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.575 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.913 HD11 ' HB ' ' A' ' 929' ' ' VAL . 7.1 pt -77.94 -26.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.2 t70 -49.94 -48.21 52.05 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 163.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -78.72 -24.54 44.87 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.192 177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.719 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.88 -56.01 24.16 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 118.921 0.782 . . . . 0.0 111.537 171.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.842 ' HB2' HG22 ' A' ' 925' ' ' VAL . 0.0 OUTLIER -55.68 -30.38 60.97 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.564 176.194 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 41.6 tp -74.77 -37.27 62.49 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.591 172.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 13.6 mptt -53.68 -38.98 64.74 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.018 0.927 . . . . 0.0 109.869 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.8 ttt -60.54 -44.59 95.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.583 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.561 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 43.3 mm -70.52 -28.7 35.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.448 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' 1045 ' ' LYS . 67.8 m -58.9 -54.65 44.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.412 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.34 0.591 . . . . 0.0 110.114 178.812 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.861 ' HD3' ' HB2' ' A' 1044 ' ' LEU . 2.0 ttt-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 43.5 t 62.66 10.3 4.07 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 122.703 0.401 . . . . 0.0 111.695 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 46.02 52.74 9.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 123.364 0.666 . . . . 0.0 110.85 -176.146 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.485 ' O ' ' N ' ' A' ' 925' ' ' VAL . 9.4 t70 -45.58 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 125.817 1.948 . . . . 0.0 112.182 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.6 tmtp? -44.82 -14.18 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.515 0.726 . . . . 0.0 111.722 -178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.819 ' HA ' HG23 ' A' ' 968' ' ' THR . 9.8 m -63.15 -53.3 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.15 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.582 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 59.2 t80 -77.62 -28.35 51.43 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.6 mt-10 -62.71 -66.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.175 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.505 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.5 t30 -66.71 -36.17 81.85 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.264 -172.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.855 ' HA ' HD11 ' A' ' 932' ' ' LEU . 9.9 p -61.66 -39.48 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 120.932 0.396 . . . . 0.0 111.339 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.553 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 59.9 m -66.24 -33.36 75.57 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.26 -30.04 60.76 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 114.55 -1.204 . . . . 0.0 112.757 172.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 1.032 HD12 ' HB2' ' A' ' 965' ' ' LEU . 6.9 mp -63.04 -45.85 90.33 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 117.941 0.871 . . . . 0.0 109.622 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.501 ' HA ' HG11 ' A' ' 936' ' ' VAL . 61.8 t -63.21 -37.34 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.648 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.556 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.5 mmpt? -68.4 -31.57 71.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.209 0.528 . . . . 0.0 110.373 175.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -77.56 -25.32 49.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.522 ' HA ' HG13 ' A' ' 958' ' ' VAL . 7.5 p -81.3 -6.71 10.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 119.714 -0.794 . . . . 0.0 109.34 172.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 66.1 mt -75.91 -33.75 26.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 165.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 24.6 mm-40 -53.24 -40.7 64.79 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.66 168.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.887 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.5 tmm? -58.12 -46.9 84.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.941 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.596 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 46.9 m -64.08 -33.08 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.201 179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.693 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 13.3 m -77.46 -45.49 25.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.953 0.882 . . . . 0.0 108.938 -176.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.531 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 8.5 mmtp -55.94 -47.1 78.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.063 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.615 ' HA ' ' OE1' ' A' ' 950' ' ' GLU . 10.9 tt -68.89 -28.89 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.515 -174.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.625 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 75.8 mt-30 -53.28 -62.03 4.12 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.693 ' HD3' ' O ' ' A' ' 941' ' ' SER . 5.7 Cg_exo -77.64 -35.69 1.44 Allowed 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.703 1.602 . . . . 0.0 114.88 -170.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.494 ' HB3' ' CG ' ' A' ' 950' ' ' GLU . . . -105.92 164.21 15.47 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -167.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.639 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 10.8 Cg_exo -74.26 179.99 5.29 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 123.845 3.03 . . . . 0.0 110.94 169.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.69 -15.56 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 124.134 3.223 . . . . 0.0 115.323 -171.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 7.0 pt-20 -57.72 -20.07 31.91 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.395 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.639 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.2 OUTLIER -87.78 -22.01 24.78 Favored 'General case' 0 CA--C 1.511 -0.524 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.659 174.288 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.687 ' HD2' ' HA ' ' A' 1002 ' ' MET . 0.3 OUTLIER -56.22 -50.47 71.18 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 123.814 0.697 . . . . 0.0 110.245 -172.246 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.021 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -75.11 -45.04 4.74 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.635 178.574 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.021 ' HD3' HG12 ' A' ' 952' ' ' VAL . 85.4 Cg_exo -56.74 -27.49 71.3 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 121.599 1.532 . . . . 0.0 114.731 172.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.887 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 26.4 ptt? -74.61 -35.68 62.94 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.758 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 1.062 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -63.21 -27.49 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.473 170.543 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.711 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.7 ttpp -56.07 -41.73 75.55 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.428 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.1 mm-40 -58.26 -46.25 86.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.36 -1.291 . . . . 0.0 111.558 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.528 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 3.3 m -74.36 -28.46 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.8 -42.35 38.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.048 -1.073 . . . . 0.0 111.861 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 57.2 tp -58.61 -34.52 71.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.244 0.545 . . . . 0.0 109.595 171.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.858 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -58.61 -48.42 81.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.736 174.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 17.9 tp -68.7 -36.85 78.99 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.726 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 46.6 ttp180 -63.77 -47.9 79.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.605 -0.684 . . . . 0.0 111.595 176.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 p -56.81 -35.7 69.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.318 0.58 . . . . 0.0 109.869 171.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 1.032 ' HB2' HD12 ' A' ' 932' ' ' LEU . 63.7 tp -64.41 -34.51 78.34 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.84 176.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 88.5 mt -58.25 -33.82 69.79 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.099 178.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.4 -43.06 91.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.63 0.728 . . . . 0.0 109.647 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.819 HG23 ' HA ' ' A' ' 925' ' ' VAL . 6.2 m -60.29 -43.4 96.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.861 173.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.554 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 76.3 t -55.3 -35.99 38.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.905 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.627 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 16.2 t70 -71.63 -22.33 61.71 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 120.504 0.193 . . . . 0.0 111.447 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.54 ' O ' HG22 ' A' ' 975' ' ' VAL . 7.2 mm-40 -70.06 -47.87 60.18 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 122.838 1.304 . . . . 0.0 108.379 170.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.614 ' OG ' HG23 ' A' ' 980' ' ' THR . 43.7 t -67.83 -25.44 65.56 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.657 -1.611 . . . . 0.0 111.67 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.626 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.6 mt -63.16 -51.34 70.38 Favored Pre-proline 0 C--O 1.218 -0.579 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.6 Cg_endo -57.48 -29.42 84.64 Favored 'Trans proline' 0 C--N 1.352 0.762 0 CA-C-N 121.594 1.605 . . . . 0.0 110.729 169.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.614 HG11 ' O ' ' A' 1042 ' ' ALA . 2.5 t -76.76 -11.29 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 119.899 -0.721 . . . . 0.0 110.885 175.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.626 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.2 tt -65.19 -56.08 22.22 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.796 176.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' A' ' 976' ' ' LEU . 31.5 Cg_exo -60.5 -31.99 93.11 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 121.297 1.331 . . . . 0.0 110.628 174.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.05 -53.06 61.82 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.315 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.757 ' CB ' ' HB3' ' A' 1045 ' ' LYS . 3.3 m -169.33 -38.32 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.712 HG21 ' HB ' ' A' ' 984' ' ' ILE . 5.5 m -57.04 -17.42 10.07 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.62 ' HA ' ' HG ' ' A' ' 976' ' ' LEU . 13.7 p-80 -48.6 -18.84 0.28 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -77.62 -54.89 5.85 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.059 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 1.034 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.8 OUTLIER -79.84 -44.21 20.93 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.315 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.712 ' HB ' HG21 ' A' ' 980' ' ' THR . 0.0 OUTLIER -59.25 -33.33 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -173.67 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.37 -36.05 68.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.661 174.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptm -67.34 -56.24 10.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.78 -176.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.573 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.66 -39.94 23.61 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 1.058 ' HA ' HD12 ' A' ' 991' ' ' LEU . 25.0 tm0? -67.47 -38.99 85.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.688 -173.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -72.5 -24.67 61.19 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.479 0.657 . . . . 0.0 109.268 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.457 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.4 tp -72.79 -41.13 65.3 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.561 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.058 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.5 mt -59.01 -50.51 73.82 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.216 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.5 -38.83 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.818 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -67.51 -38.77 84.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.408 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.688 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -113.31 -30.13 7.01 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -170.669 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.113 ' HA ' HD12 ' A' 1028 ' ' LEU . 4.2 mm? -55.95 -51.16 68.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 166.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.753 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -60.65 -44.33 96.54 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.582 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.571 ' HG3' ' HE2' ' A' 1001 ' ' LYS . 6.3 tp10 -51.97 -42.93 63.29 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.983 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.686 ' O ' ' HG2' ' A' 1002 ' ' MET . 3.8 mm? -70.94 -33.1 70.17 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.568 -175.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.795 ' HA ' HG11 ' A' ' 955' ' ' VAL . 8.2 pt -62.65 -23.57 33.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.095 177.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.739 ' O ' ' HB2' ' A' 1004 ' ' LEU . 17.0 m-80 -94.52 -10.3 32.64 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.262 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.571 ' HE2' ' HG3' ' A' ' 997' ' ' GLU . 73.0 mmtt -83.36 -40.14 19.81 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.062 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 8.6 mmt -70.81 -44.2 67.06 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' 1007 ' ' GLN . 86.2 tttt -57.62 -45.69 85.07 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.464 173.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.739 ' HB2' ' O ' ' A' 1000 ' ' ASN . 17.0 tp -55.09 -53.53 54.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.454 0.702 . . . . 0.0 112.824 172.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.25 -41.74 93.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.077 0.465 . . . . 0.0 110.58 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.06 -18.05 59.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.555 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.729 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.4 tp-100 -75.94 -41.03 52.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.362 178.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.577 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.354 176.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.549 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? . . . . . 0 CA--C 1.523 -0.065 0 CA-C-O 120.795 0.331 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 1.6 mp0 -61.7 -33.37 73.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.765 -176.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.73 -47.75 50.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.682 0.277 . . . . 0.0 111.232 169.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.615 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.9 m-30 -76.12 -22.09 55.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.195 0.521 . . . . 0.0 110.508 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.678 ' HG3' ' OH ' ' A' ' 951' ' ' TYR . 75.7 tttt -73.03 -41.81 63.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.164 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.84 -18.64 61.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.962 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -77.24 -40.57 44.33 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' 1002 ' ' MET . 1.5 tmt? -66.04 -38.83 89.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.869 174.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 7.6 tt -55.38 -50.8 68.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.895 0.379 . . . . 0.0 110.405 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 13.1 m -67.62 -34.64 77.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.486 0.66 . . . . 0.0 110.808 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -74.36 -37.49 63.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.097 -176.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -66.26 -32.04 73.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.649 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.563 ' O ' HG22 ' A' 1030 ' ' VAL . 12.0 t-80 -66.67 -32.49 73.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.4 -50.97 57.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.923 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 1.113 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -67.4 -30.7 70.53 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.261 0.553 . . . . 0.0 110.304 -178.168 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.634 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.52 -41.41 76.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.853 170.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' 1026 ' ' HIS . 88.8 t -66.67 -31.12 52.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.649 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.688 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 5.8 m-20 -59.07 -47.48 85.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.046 0.45 . . . . 0.0 109.961 176.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.12 87.19 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.567 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.748 ' O ' ' HG ' ' A' 1036 ' ' LEU . 31.0 mmmt -63.31 -36.63 84.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.123 0.487 . . . . 0.0 111.358 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.646 ' O ' HG21 ' A' 1038 ' ' VAL . 2.3 t30 -68.71 -39.67 80.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.381 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.851 HD23 HD11 ' A' ' 991' ' ' LEU . 12.1 tp -78.86 -22.23 46.35 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.866 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' 1033 ' ' LYS . 4.1 pp -67.95 -31.59 71.44 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.644 ' O ' ' HB2' ' A' 1041 ' ' GLN . 28.3 t70 -75.89 -31.89 59.41 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.512 171.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 1.034 HG13 ' HB3' ' A' ' 983' ' ' GLU . 33.9 t -64.04 -67.31 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.297 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.734 HG12 ' O ' ' A' 1035 ' ' LEU . 7.7 pt -80.99 -32.23 12.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.061 -170.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.582 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 12.6 t0 -55.11 -45.93 75.52 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 166.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.644 ' HB2' ' O ' ' A' 1037 ' ' ASP . 2.7 mp0 -67.86 -28.65 67.72 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.147 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.614 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -52.81 -53.18 52.13 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-O 120.861 0.362 . . . . 0.0 111.063 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.446 ' HB3' ' HG3' ' A' ' 920' ' ' ARG . 0.9 OUTLIER -54.21 -36.6 63.64 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.008 176.052 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.861 ' HB2' ' HD3' ' A' ' 920' ' ' ARG . 14.6 tp -76.81 -25.25 53.07 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.982 -0.449 . . . . 0.0 111.539 173.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.757 ' HB3' ' CB ' ' A' ' 979' ' ' SER . 25.0 mmtp -63.21 -21.39 66.19 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 172.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' 1043 ' ' ARG . 11.9 tmm? -74.89 -43.91 51.77 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.728 -1.123 . . . . 0.0 108.913 176.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.459 ' HB ' HD13 ' A' 1044 ' ' LEU . 3.9 mp -61.31 -41.57 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 121.609 0.719 . . . . 0.0 109.868 170.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.541 ' HB2' ' HA ' ' A' 1045 ' ' LYS . 32.8 m -69.35 -12.73 61.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.093 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.391 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.548 ' HG3' ' HB3' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 120.964 0.411 . . . . 0.0 110.17 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 17.7 p -91.31 25.38 2.58 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.551 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.479 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.28 54.71 7.02 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.218 -175.553 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.48 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -47.01 -173.27 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 125.763 1.914 . . . . 0.0 112.084 -176.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.579 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.0 tmtm? -39.01 -22.74 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.385 0.674 . . . . 0.0 111.685 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 1.008 ' HA ' HG22 ' A' ' 968' ' ' THR . 14.8 m -56.64 -52.82 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.599 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.426 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 12.9 t80 -77.91 -32.99 52.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -61.19 -58.57 7.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 113.208 -1.815 . . . . 0.0 112.102 -174.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.446 ' OD1' HG21 ' A' ' 964' ' ' THR . 0.2 OUTLIER -71.99 -32.27 67.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.59 -172.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.554 ' HA ' HD13 ' A' ' 965' ' ' LEU . 39.9 t -63.33 -35.09 70.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.092 173.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.528 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -65.33 -39.05 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 169.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.07 -29.75 62.85 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.935 175.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.79 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 22.5 tp -65.39 -38.79 91.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.487 ' O ' HG12 ' A' ' 936' ' ' VAL . 38.2 t -67.66 -40.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.13 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -61.8 -30.6 70.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.159 0.504 . . . . 0.0 110.107 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.595 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -76.65 -26.33 54.72 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.354 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 933' ' ' VAL . 8.0 p -85.04 -4.97 9.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.899 0.857 . . . . 0.0 109.092 172.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.517 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 62.4 mt -81.46 -38.63 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 163.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.597 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 73.0 mm-40 -52.77 -40.28 63.0 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.364 167.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.678 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.26 -44.93 92.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.839 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.608 ' O ' HG22 ' A' ' 943' ' ' ILE . 5.0 p -74.57 -27.36 60.46 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.418 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.4 p -79.13 -44.98 20.93 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.703 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 0.1 OUTLIER -51.35 -43.53 61.83 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 113.304 -1.771 . . . . 0.0 110.889 172.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.782 HG12 ' HE2' ' A' ' 954' ' ' MET . 0.3 OUTLIER -67.54 -29.37 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 O-C-N 123.841 0.713 . . . . 0.0 110.746 -175.498 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.796 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.8 mm-40 -52.01 -58.58 10.81 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-O 119.398 -0.334 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.796 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 56.6 Cg_endo -101.25 26.22 0.13 Allowed 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 121.884 1.723 . . . . 0.0 113.166 175.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -83.86 121.87 76.1 Favored Pre-proline 0 C--N 1.33 -0.249 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -174.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.73 ' HD2' ' HG3' ' A' ' 950' ' ' GLU . 92.7 Cg_endo -82.04 -176.2 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.814 2.343 . . . . 0.0 109.568 156.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.932 ' HA ' ' HD2' ' A' ' 951' ' ' TYR . 8.9 Cg_endo -51.71 -41.15 63.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.456 2.104 . . . . 0.0 112.743 177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -64.69 -7.41 10.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.021 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.73 ' HG3' ' HD2' ' A' ' 947' ' ' PRO . 5.9 mm-40 -109.46 -17.09 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.261 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.932 ' HD2' ' HA ' ' A' ' 948' ' ' PRO . 31.8 m-85 -59.42 -37.3 77.7 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.056 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.41 -50.41 2.77 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.621 177.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.056 ' HD3' HG12 ' A' ' 952' ' ' VAL . 89.1 Cg_exo -56.31 -36.74 97.36 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.727 2.284 . . . . 0.0 114.854 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.792 ' HE1' ' HA ' ' A' ' 951' ' ' TYR . 20.6 ptp -60.14 -47.52 85.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.747 0.784 . . . . 0.0 108.973 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.673 ' HB ' ' HB3' ' A' 1002 ' ' MET . 61.8 t -65.22 -28.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.334 172.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -62.06 -37.34 84.63 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 938' ' ' GLU . 71.1 mm-40 -55.74 -47.14 77.44 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.608 174.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 1.008 HG21 HD23 ' A' ' 998' ' ' LEU . 3.6 m -72.47 -28.88 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.791 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.511 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -73.39 -44.92 32.12 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.063 -1.065 . . . . 0.0 111.783 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.65 -31.72 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.79 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.41 -55.23 36.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.531 178.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 4.6 tt -65.34 -32.77 74.58 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.327 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.479 ' HA ' ' HD3' ' A' ' 963' ' ' ARG . 30.8 mmt180 -65.02 -48.64 73.19 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 122.009 -0.432 . . . . 0.0 111.583 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.446 HG21 ' OD1' ' A' ' 928' ' ' ASN . 11.1 m -60.04 -37.46 79.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.358 0.599 . . . . 0.0 109.937 172.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.637 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 3.2 tt -59.03 -30.43 68.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.49 173.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.507 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 52.5 tp -66.6 -31.44 72.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.536 ' O ' ' HB3' ' A' ' 970' ' ' ASP . . . -65.65 -41.45 92.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.942 0.877 . . . . 0.0 109.658 173.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 1.008 HG22 ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -60.96 -38.6 86.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.742 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 70.7 t -55.4 -30.79 26.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.001 171.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.624 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.7 t70 -65.45 -29.59 70.28 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 122.406 -0.184 . . . . 0.0 111.313 177.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.605 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 54.2 mm-40 -65.95 -52.11 52.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 122.293 1.044 . . . . 0.0 109.658 172.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.501 ' HB3' ' CG1' ' A' 1039 ' ' ILE . 60.7 p -66.35 -23.3 66.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.153 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.85 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 65.1 tp -58.66 -54.72 53.39 Favored Pre-proline 0 C--O 1.217 -0.606 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 26.1 Cg_exo -64.86 -25.55 60.18 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.397 1.535 . . . . 0.0 110.319 172.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.581 HG11 ' O ' ' A' 1042 ' ' ALA . 5.3 t -75.6 -16.37 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 119.909 -0.717 . . . . 0.0 111.5 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.85 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 4.6 pp -80.45 -38.48 1.09 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 118.344 -0.836 . . . . 0.0 113.001 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.705 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 21.9 Cg_exo -66.34 -26.63 48.28 Favored 'Trans proline' 0 C--N 1.36 1.132 0 CA-C-N 121.578 1.599 . . . . 0.0 110.0 171.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . 0.641 ' HB3' ' HG3' ' A' 1049 ' ' GLN . . . -69.84 -51.82 30.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.266 173.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.839 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.8 m -162.57 -48.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.948 HG21 ' HB ' ' A' ' 984' ' ' ILE . 51.4 m -46.92 -20.45 0.14 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.644 ' HB2' ' O ' ' A' ' 976' ' ' LEU . 19.5 t-80 -51.72 -20.15 1.97 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -76.81 -54.45 6.6 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.941 -177.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 1.055 ' HB2' HG22 ' A' 1038 ' ' VAL . 7.9 pm0 -78.64 -37.39 42.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 121.813 -0.554 . . . . 0.0 111.839 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.948 ' HB ' HG21 ' A' ' 980' ' ' THR . 9.8 tp -62.03 -21.88 27.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.45 -47.13 51.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.059 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.513 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 22.7 ptp -72.26 -46.26 56.63 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.768 -170.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.648 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.73 -45.55 20.95 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -175.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.973 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.9 tt0 -62.21 -43.68 98.29 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.178 -175.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.638 ' HZ1' ' HB3' ' A' ' 989' ' ' LYS . 9.8 mtpm? -66.63 -32.61 74.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.415 0.626 . . . . 0.0 109.474 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.817 HD22 HD21 ' A' 1034 ' ' ASN . 3.3 tp -65.13 -43.72 91.01 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.378 177.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.037 HD21 ' HB3' ' A' 1031 ' ' ASP . 22.8 mt -60.0 -45.98 90.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.01 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.94 -41.55 71.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.654 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.1 m -73.04 -34.37 66.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.256 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.672 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -103.97 -31.67 9.62 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -170.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.822 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.9 OUTLIER -57.93 -38.46 75.96 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 165.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.488 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -55.57 -48.98 73.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.685 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -65.75 -32.31 73.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.718 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 1.008 HD23 HG21 ' A' ' 958' ' ' VAL . 14.1 tp -71.34 -26.78 62.97 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 119.11 -1.036 . . . . 0.0 108.898 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 64.4 mt -62.36 -27.14 42.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.375 0.607 . . . . 0.0 109.605 169.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.688 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 77.5 m-20 -80.68 -6.71 58.77 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.648 ' HA ' ' HG3' ' A' 1021 ' ' MET . 58.2 tttm -80.07 -45.24 18.62 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 172.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.84 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 17.7 ptp -64.34 -38.0 89.47 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 175.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.836 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.6 tttp -67.87 -61.94 1.64 Allowed 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.712 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' A' 1000 ' ' ASN . 4.8 tp -56.49 -56.08 25.72 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -173.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.6 -46.62 83.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.16 0.505 . . . . 0.0 110.785 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -24.14 54.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.952 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.836 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.0 OUTLIER -69.07 -46.08 68.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.825 -173.456 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.63 ' HB2' ' CE2' ' A' 1017 ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 119.989 -0.684 . . . . 0.0 111.256 175.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.71 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -52.82 -38.27 61.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -165.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -47.19 -51.56 18.15 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.079 0.466 . . . . 0.0 111.684 171.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.63 ' CE2' ' HB2' ' A' 1008 ' ' TYR . 3.2 m-85 -68.33 -23.87 64.76 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.968 0.889 . . . . 0.0 109.204 -173.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.71 ' HB2' HE22 ' A' 1014 ' ' GLN . 85.3 tttt -79.41 -41.66 27.17 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.05 176.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 79.0 tttt -77.96 -33.76 51.38 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.59 0.71 . . . . 0.0 111.643 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.01 -45.74 14.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.276 -0.874 . . . . 0.0 108.9 -171.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.768 ' HA ' ' HE3' ' A' 1021 ' ' MET . 25.8 mmt -75.37 -17.74 60.14 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.824 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' 1018 ' ' LYS . 58.8 tp -63.45 -43.53 97.13 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 171.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.3 m -61.62 -28.65 69.52 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.3 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.82 -30.92 51.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.742 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -67.45 -40.61 85.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.327 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.526 ' O ' HG23 ' A' 1030 ' ' VAL . 14.8 t-80 -58.39 -38.02 76.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.103 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.0 -49.54 69.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.822 HD11 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -68.3 -29.05 67.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.34 0.59 . . . . 0.0 110.07 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.489 ' N ' HD22 ' A' 1028 ' ' LEU . . . -59.75 -42.68 93.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.604 172.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' 1026 ' ' HIS . 47.7 t -67.03 -31.4 53.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.957 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 1.037 ' HB3' HD21 ' A' ' 991' ' ' LEU . 2.4 m-20 -56.19 -46.93 79.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.665 173.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.79 -53.53 57.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.313 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -54.1 -42.0 68.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.905 0.384 . . . . 0.0 111.646 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.817 HD21 HD22 ' A' ' 990' ' ' LEU . 50.6 t30 -63.72 -49.83 71.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.823 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.92 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -73.13 -27.57 61.75 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.451 ' N ' HG11 ' A' ' 929' ' ' VAL . 4.4 tt -57.5 -35.86 70.77 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.527 0.731 . . . . 0.0 110.737 177.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -92.51 -33.68 14.37 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 1.055 HG22 ' HB2' ' A' ' 983' ' ' GLU . 2.0 t -56.09 -46.57 80.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.367 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.563 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.2 tt -93.48 -28.51 4.38 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.938 -172.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 7.5 t70 -57.33 -42.81 82.61 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 161.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' 1045 ' ' LYS . 15.2 mm100 -69.81 -31.44 69.35 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.707 174.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.581 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -53.82 -56.11 20.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.05 0.452 . . . . 0.0 110.553 171.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.716 ' HB2' HG22 ' A' ' 925' ' ' VAL . 7.2 tpt180 -57.29 -33.86 68.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.618 177.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.444 HD11 HH11 ' A' ' 920' ' ' ARG . 63.3 tp -69.01 -41.82 77.25 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 121.094 -0.243 . . . . 0.0 111.066 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.839 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 42.1 mmtm -51.09 -37.39 45.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.029 0.919 . . . . 0.0 110.079 174.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.434 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 28.0 ttt -68.82 -38.06 79.61 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.271 -1.331 . . . . 0.0 110.017 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' 1043 ' ' ARG . 42.8 mm -67.56 -36.3 75.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.38 173.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.519 ' HB2' ' O ' ' A' 1045 ' ' LYS . 71.0 m -56.15 -51.39 68.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.305 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1049 ' ' GLN . . . . . 0.641 ' HG3' ' HB3' ' A' ' 978' ' ' ALA . 15.8 mm100 . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.219 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.707 ' HB3' ' HD3' ' A' 1043 ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.624 0.25 . . . . 0.0 110.791 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.616 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 28.4 t -68.89 139.09 55.13 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 166.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.639 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER -72.02 67.91 0.66 Allowed 'General case' 0 CA--C 1.499 -1.002 0 C-N-CA 122.538 0.335 . . . . 0.0 111.524 -173.463 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 925' ' ' VAL . 8.2 t70 -47.87 -173.92 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 O-C-N 125.902 2.001 . . . . 0.0 112.325 -173.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.504 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 5.1 tmtp? -39.27 -19.76 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 124.042 0.937 . . . . 0.0 112.508 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.924 ' HA ' HG21 ' A' ' 968' ' ' THR . 3.7 m -62.01 -57.16 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 123.037 0.535 . . . . 0.0 112.193 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.536 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 23.3 t80 -78.97 -31.28 44.87 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 122.206 1.003 . . . . 0.0 108.764 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 7.8 mm-40 -60.84 -59.49 5.3 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.953 -1.476 . . . . 0.0 112.188 -175.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.497 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 5.1 t30 -73.65 -32.54 64.05 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.671 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.801 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.7 p -62.63 -37.11 78.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 119.904 -0.719 . . . . 0.0 110.423 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.521 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 31.0 m -66.65 -33.94 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.291 0.567 . . . . 0.0 109.586 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.27 -31.07 65.29 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.381 173.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.697 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 25.9 tp -62.99 -41.78 99.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.004 0.43 . . . . 0.0 109.886 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 937' ' ' ILE . 48.2 t -62.3 -43.02 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 0.0 110.011 174.081 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -55.95 -40.89 73.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.724 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.36 -31.63 62.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.864 -177.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.503 HG12 ' HA ' ' A' ' 933' ' ' VAL . 13.0 p -77.41 -16.8 14.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.441 174.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.5 mm -72.55 -42.46 63.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 165.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 45.1 mt-10 -54.44 -37.2 64.87 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.937 172.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.546 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 42.9 ttp -57.94 -45.86 85.94 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.5 t -72.48 -32.84 66.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.857 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.578 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 24.0 m -77.64 -47.01 20.33 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.999 0.905 . . . . 0.0 109.968 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.542 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -78.86 -15.94 57.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.477 -174.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.85 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 6.8 tt -78.99 -25.62 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.106 172.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.69 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.2 mm-40 -50.93 -53.72 44.81 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.69 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.1 Cg_endo -104.43 36.26 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.09 1.86 . . . . 0.0 114.319 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.679 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -138.16 155.53 74.26 Favored Pre-proline 0 N--CA 1.466 0.33 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.516 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 50.5 Cg_endo -90.47 -176.72 1.1 Allowed 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 124.043 3.162 . . . . 0.0 112.091 176.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.784 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.8 Cg_exo -51.96 -31.77 44.99 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.976 2.451 . . . . 0.0 113.086 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.421 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 47.1 mt-10 -53.99 -36.17 62.63 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.557 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.679 ' HB2' ' HB2' ' A' ' 946' ' ' ALA . 2.4 mp0 -98.65 0.09 44.03 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.784 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 15.8 m-30 -61.27 -41.21 96.55 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.034 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -75.02 -51.25 3.64 Favored Pre-proline 0 CA--C 1.557 1.212 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.729 176.05 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.998 ' HD3' HG11 ' A' ' 952' ' ' VAL . 79.9 Cg_exo -51.54 -33.74 49.19 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.408 2.072 . . . . 0.0 115.112 173.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.85 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 27.3 ptt? -67.48 -45.84 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.182 0.515 . . . . 0.0 109.997 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.693 HG13 ' HG ' ' A' ' 998' ' ' LEU . 87.2 t -64.67 -27.14 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.502 173.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.863 ' HB3' ' HZ2' ' A' ' 956' ' ' LYS . 3.7 ttpm? -59.4 -37.02 76.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -54.69 -46.09 74.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.882 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.45 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.1 t -69.95 -36.23 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.851 176.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.531 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -69.02 -44.46 67.16 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.358 -0.925 . . . . 0.0 112.872 -176.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.21 -32.34 72.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.884 0.374 . . . . 0.0 110.486 171.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.697 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -63.19 -55.92 21.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.616 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.479 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 1.8 tm? -63.8 -35.03 79.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.527 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -57.42 -57.38 12.93 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 121.827 -0.546 . . . . 0.0 111.114 171.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -55.81 -31.07 62.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.367 0.603 . . . . 0.0 110.65 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.731 HD13 HD23 ' A' 1035 ' ' LEU . 2.5 tm? -65.56 -39.87 92.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.057 176.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.489 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 8.6 tt -54.75 -33.53 61.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.043 176.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.25 79.27 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 110.317 174.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.924 HG21 ' HA ' ' A' ' 925' ' ' VAL . 1.4 m -56.03 -40.75 73.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.837 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.652 HG11 HD13 ' A' ' 984' ' ' ILE . 79.1 t -54.2 -32.0 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.681 173.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.748 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 24.9 t70 -68.06 -32.37 72.66 Favored 'General case' 0 C--O 1.219 -0.506 0 O-C-N 122.472 -0.143 . . . . 0.0 111.01 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.63 -53.0 63.13 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.78 1.276 . . . . 0.0 108.575 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.761 ' HG ' HG21 ' A' ' 980' ' ' THR . 26.7 t -65.42 -22.35 66.76 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.106 -1.406 . . . . 0.0 112.176 178.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.616 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.4 tt -59.73 -54.96 50.57 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.916 -177.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.748 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.8 Cg_endo -58.84 -22.42 62.18 Favored 'Trans proline' 0 C--N 1.357 1.007 0 CA-C-N 121.58 1.6 . . . . 0.0 111.133 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.575 HG12 ' HB2' ' A' 1046 ' ' MET . 60.0 t -74.35 -16.44 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.038 173.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.967 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -75.19 -41.37 3.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.42 -0.8 . . . . 0.0 112.409 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.967 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 23.7 Cg_exo -65.69 -27.07 52.91 Favored 'Trans proline' 0 C--N 1.361 1.219 0 CA-C-N 120.957 1.378 . . . . 0.0 110.354 171.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.06 -60.49 2.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.775 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.532 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 37.4 m -166.56 -34.2 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.78 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 1.5 t -63.38 -15.71 58.31 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -167.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.63 ' HA ' HG21 ' A' ' 984' ' ' ILE . 81.3 t60 -49.38 -21.03 0.78 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -71.29 -53.59 13.74 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.019 -0.673 . . . . 0.0 110.732 176.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 1.118 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.7 OUTLIER -76.75 -42.69 40.1 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.652 HD13 HG11 ' A' ' 969' ' ' VAL . 11.3 tp -59.38 -28.54 39.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.892 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -73.53 -40.95 63.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.533 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.592 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 20.4 ptp -64.87 -57.48 8.72 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.055 -172.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.16 -42.04 27.08 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -174.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.965 ' HA ' HD12 ' A' ' 991' ' ' LEU . 41.6 tt0 -57.35 -42.91 82.92 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.213 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -68.62 -31.02 69.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.366 0.603 . . . . 0.0 109.512 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.814 ' HG ' ' CG ' ' A' 1031 ' ' ASP . 3.1 tp -75.42 -31.81 60.5 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.673 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.965 HD12 ' HA ' ' A' ' 988' ' ' GLN . 44.1 mt -64.71 -49.79 69.49 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.229 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.412 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 26.8 t-20 -58.24 -40.39 81.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.535 -177.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.2 m -76.98 -35.33 57.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.465 -176.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.96 -31.48 12.15 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.049 ' HA ' HD23 ' A' 1028 ' ' LEU . 1.8 tm? -56.43 -37.64 70.5 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 162.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.568 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -60.42 -48.01 83.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.89 176.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.467 ' O ' ' HD3' ' A' 1001 ' ' LYS . 18.5 mt-10 -59.47 -37.09 77.31 Favored 'General case' 0 CA--C 1.504 -0.797 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.712 176.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.693 ' HG ' HG13 ' A' ' 955' ' ' VAL . 24.2 tp -68.63 -33.42 73.98 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.658 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.647 ' HB ' ' HE2' ' A' 1002 ' ' MET . 33.8 pt -79.26 -25.24 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.911 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.534 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.4 m-80 -79.73 -17.06 54.43 Favored 'General case' 0 C--O 1.211 -0.968 0 O-C-N 122.219 -0.3 . . . . 0.0 110.349 167.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.68 ' CG ' ' HA ' ' A' 1021 ' ' MET . 0.3 OUTLIER -86.49 -31.71 21.17 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.619 178.342 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.034 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -69.18 -36.28 77.17 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 167.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.781 ' O ' ' HB2' ' A' 1007 ' ' GLN . 59.9 tttp -62.44 -56.14 20.99 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.921 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' 1000 ' ' ASN . 29.1 mt -58.88 -43.86 91.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.33 -46.78 85.56 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.134 0.492 . . . . 0.0 110.23 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.24 -19.2 56.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.16 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.781 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -76.21 -44.82 36.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.453 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.702 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.541 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -54.98 -43.76 73.81 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.2 tt0 -50.27 -43.82 53.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.443 174.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.414 ' CE2' HD21 ' A' 1004 ' ' LEU . 2.1 m-30 -77.97 -23.4 48.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.547 0.213 . . . . 0.0 110.681 -179.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.541 ' HB2' HE22 ' A' 1014 ' ' GLN . 39.3 ttpt -65.76 -37.0 85.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -71.29 -48.97 47.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.2 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' 1016 ' ' GLU . 70.7 mm-40 -52.13 -37.45 54.37 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 110.564 172.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.68 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 51.8 ttp -63.52 -50.21 70.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.75 176.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' 1018 ' ' LYS . 98.0 mt -61.9 -28.78 69.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.866 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 37.8 m -66.44 -36.73 83.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.489 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.559 ' HB3' ' HZ2' ' A' 1001 ' ' LYS . . . -78.57 -40.03 35.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.577 177.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.7 80.05 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.237 176.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.401 ' O ' HG22 ' A' 1030 ' ' VAL . 13.9 t60 -54.79 -51.59 65.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.441 176.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.632 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 1.049 HD23 ' HA ' ' A' ' 995' ' ' LEU . 12.3 tp -73.39 -42.6 61.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.218 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.25 84.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' 1026 ' ' HIS . 54.7 t -67.03 -42.02 88.01 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.335 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.814 ' CG ' ' HG ' ' A' ' 990' ' ' LEU . 25.4 t0 -66.04 -32.29 73.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 176.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.12 -44.97 71.78 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 167.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.681 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 41.6 mtpt -70.84 -23.08 62.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.932 174.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.552 ' O ' HG23 ' A' 1038 ' ' VAL . 48.9 t30 -74.0 -43.79 56.8 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.819 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tp -79.85 -21.51 44.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.136 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.801 ' HA ' HG11 ' A' ' 929' ' ' VAL . 2.7 pp -72.08 -22.03 61.42 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.3 t70 -81.15 -48.08 12.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.506 168.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 1.118 HG12 ' HB3' ' A' ' 983' ' ' GLU . 18.4 t -47.89 -61.69 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.444 176.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.719 HG12 ' HB ' ' A' ' 925' ' ' VAL . 8.7 tt -89.75 -25.47 5.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 CA-C-N 114.351 -1.295 . . . . 0.0 112.061 -167.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.842 ' O ' ' HG3' ' A' 1043 ' ' ARG . 18.5 t70 -63.34 -33.36 75.35 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 118.983 -1.087 . . . . 0.0 109.032 162.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' 1037 ' ' ASP . 60.6 mt-30 -76.61 -26.86 55.42 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 118.735 -1.186 . . . . 0.0 109.149 171.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.629 ' HA ' ' HB2' ' A' 1045 ' ' LYS . . . -55.01 -50.31 69.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 117.913 0.324 . . . . 0.0 110.581 171.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.842 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -53.39 -41.33 65.81 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.815 178.671 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.613 ' N ' ' HD2' ' A' 1043 ' ' ARG . 31.8 tp -79.85 -29.82 40.17 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 122.006 -0.434 . . . . 0.0 111.395 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.78 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 7.6 mptt -55.05 -46.39 75.35 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.811 0.844 . . . . 0.0 110.173 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.575 ' HB2' HG12 ' A' ' 975' ' ' VAL . 24.8 ttt -62.23 -45.01 95.26 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.715 178.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.458 ' CD1' ' HB2' ' A' ' 920' ' ' ARG . 1.7 mp -67.99 -21.48 26.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.573 176.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' 1045 ' ' LYS . 32.5 t -66.63 -36.85 83.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 0.0 110.422 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.225 179.839 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 1.107 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 120.729 0.3 . . . . 0.0 111.675 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.0 t -113.18 31.54 6.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.175 -175.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.485 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER 51.16 56.38 8.06 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.125 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.3 m-20 -47.26 -173.17 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.101 2.125 . . . . 0.0 112.932 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.8 tmtm? -40.27 -17.38 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.453 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.71 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -63.63 -53.23 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.767 174.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -77.55 -29.92 52.46 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 46.5 mt-10 -61.07 -60.73 3.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.278 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.457 HD22 HG22 ' A' ' 964' ' ' THR . 10.4 t-20 -67.91 -41.74 82.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.247 -171.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.859 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.1 p -60.09 -37.8 74.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.255 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.422 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 28.1 m -68.59 -31.17 70.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.099 0.476 . . . . 0.0 110.069 173.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.56 -32.21 68.54 Favored Glycine 0 CA--C 1.521 0.463 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.149 172.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.988 HD11 ' HB2' ' A' 1032 ' ' ALA . 3.4 tm? -61.54 -45.48 93.98 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.3 t -58.86 -42.71 86.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.209 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.5 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.0 mmtp -67.14 -21.61 65.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.365 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.16 -31.61 44.05 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.757 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.98 -13.91 11.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 119.679 -0.809 . . . . 0.0 109.04 172.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.606 HG12 ' O ' ' A' ' 933' ' ' VAL . 45.9 mm -68.21 -43.04 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 164.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 6.4 mm-40 -54.05 -45.17 71.58 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.298 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.784 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.0 tmt? -57.59 -42.18 82.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.251 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.533 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 24.2 m -69.04 -30.51 68.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.104 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.57 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 16.7 m -78.33 -43.14 28.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.3 mmtp -56.16 -42.08 76.46 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 113.335 -1.757 . . . . 0.0 111.759 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.714 HD12 ' HE2' ' A' 1018 ' ' LYS . 13.9 tt -73.82 -23.26 18.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.05 -177.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 34.4 mm-40 -53.67 -62.75 3.26 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.2 Cg_endo -99.95 -4.0 0.61 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.545 1.496 . . . . 0.0 114.515 -175.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.654 ' HB2' ' HG3' ' A' ' 950' ' ' GLU . . . -114.15 150.19 43.22 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -170.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 3.4 Cg_exo -82.84 -178.56 3.95 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.223 3.282 . . . . 0.0 112.961 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.7 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 85.7 Cg_exo -50.03 -33.16 33.65 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 123.624 2.883 . . . . 0.0 114.269 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.62 -29.74 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.493 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.654 ' HG3' ' HB2' ' A' ' 946' ' ' ALA . 63.9 mm-40 -97.45 -4.95 37.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.108 177.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.759 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 10.3 m-30 -56.34 -40.79 75.03 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 172.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.011 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.5 OUTLIER -77.13 -48.57 2.51 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.786 176.162 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.011 ' HD3' HG12 ' A' ' 952' ' ' VAL . 88.2 Cg_exo -52.56 -27.62 33.39 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 121.702 1.601 . . . . 0.0 114.6 172.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.784 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 19.9 ptp -74.2 -34.86 63.86 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.435 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.74 HG13 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -65.98 -26.76 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.745 171.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.713 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.2 tttm -53.24 -44.18 67.91 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 173.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 935' ' ' ALA . 2.9 mm-40 -55.49 -47.67 75.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.818 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.46 HG23 HD21 ' A' ' 998' ' ' LEU . 5.0 m -75.31 -30.77 23.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.33 -45.29 31.01 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.873 -174.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.65 -27.3 68.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.81 0.338 . . . . 0.0 110.341 172.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.454 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -61.59 -52.78 62.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.673 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.593 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 2.8 tm? -66.53 -31.24 71.84 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.559 0.618 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.546 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 50.6 ttm-85 -64.61 -48.07 76.27 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 121.784 -0.572 . . . . 0.0 111.074 173.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.457 HG22 HD22 ' A' ' 928' ' ' ASN . 39.7 m -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.262 0.553 . . . . 0.0 110.11 171.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 929' ' ' VAL . 0.5 OUTLIER -61.3 -39.42 90.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.668 176.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.546 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 52.4 tp -52.21 -32.9 38.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.646 174.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.72 98.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.435 0.636 . . . . 0.0 109.783 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.71 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.7 m -62.38 -38.66 90.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.241 172.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.658 HG12 HD13 ' A' ' 984' ' ' ILE . 93.6 t -54.05 -29.57 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.028 173.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.536 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 17.7 t70 -75.92 -25.59 56.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.798 -0.183 . . . . 0.0 111.041 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -66.92 -51.97 48.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.39 1.09 . . . . 0.0 109.163 171.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.405 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 33.3 p -63.7 -22.48 66.93 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.918 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.585 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 22.1 tp -54.45 -57.21 19.72 Favored Pre-proline 0 CA--C 1.54 0.579 0 CA-C-O 118.697 -0.668 . . . . 0.0 112.221 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.536 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 20.4 Cg_endo -64.16 -20.64 67.42 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.136 1.442 . . . . 0.0 111.167 173.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' 1042 ' ' ALA . 54.5 t -75.17 -18.81 16.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.116 175.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.684 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.9 pp -74.89 -44.36 4.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.882 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.684 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 21.7 Cg_endo -64.3 -26.95 63.71 Favored 'Trans proline' 0 C--N 1.364 1.353 0 CA-C-N 121.145 1.445 . . . . 0.0 110.64 172.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.37 -59.84 3.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.593 172.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.57 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 75.2 m -160.82 -49.01 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.695 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 2.0 t -56.59 -14.35 3.11 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -166.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.571 ' HA ' HG23 ' A' ' 984' ' ' ILE . 20.8 p-80 -51.26 -22.88 3.01 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -170.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.471 ' HA ' ' NE ' ' A' ' 982' ' ' ARG . 4.1 tpm_? -78.69 -51.18 10.19 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 110.026 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.831 ' HG3' HG23 ' A' 1038 ' ' VAL . 2.7 tp10 -73.34 -42.77 61.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.964 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.658 HD13 HG12 ' A' ' 969' ' ' VAL . 0.1 OUTLIER -55.79 -40.18 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -173.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -73.37 -31.18 63.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.792 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.603 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptp -63.89 -49.13 73.93 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.876 -178.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.599 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.18 -39.12 34.17 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 116.876 -0.147 . . . . 0.0 111.174 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 1.018 ' HA ' HD11 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -58.11 -47.6 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.799 -178.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -60.83 -35.83 77.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.543 0.687 . . . . 0.0 109.47 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.412 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.4 OUTLIER -68.25 -45.0 74.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.757 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.018 HD11 ' HA ' ' A' ' 988' ' ' GLN . 3.8 mt -58.76 -55.8 30.39 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.546 0.689 . . . . 0.0 110.507 -177.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -59.93 -33.1 71.45 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.821 -171.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 12.2 p -74.55 -38.49 62.72 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.663 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 51.3 m-20 -103.17 -28.63 11.81 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.087 -172.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.879 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.56 -42.83 93.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.217 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.594 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -64.15 -44.35 92.39 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.926 175.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.584 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 38.2 tt0 -53.41 -46.55 69.79 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.492 176.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.618 ' O ' ' HG2' ' A' 1002 ' ' MET . 28.2 tp -67.08 -38.55 85.95 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.898 -173.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.74 ' HA ' HG22 ' A' ' 955' ' ' VAL . 32.1 pt -61.05 -31.56 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.541 -178.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.619 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -95.32 -12.48 26.04 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.195 178.358 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.584 ' HG3' ' HG2' ' A' ' 997' ' ' GLU . 4.7 mmmm -84.74 -33.88 22.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.799 0.333 . . . . 0.0 110.453 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.679 ' SD ' ' HG3' ' A' 1021 ' ' MET . 72.7 mmm -74.4 -44.54 51.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 174.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' 1007 ' ' GLN . 47.1 tttp -53.47 -44.27 68.83 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.872 167.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.71 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 18.1 tp -58.71 -49.02 79.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 175.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.699 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -59.12 -40.28 84.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.561 0.696 . . . . 0.0 109.671 175.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.638 ' HG3' HG11 ' A' ' 952' ' ' VAL . 1.1 tm0? -64.49 -33.3 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.733 173.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.31 -24.36 50.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.123 -174.188 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.684 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.4 t80 . . . . . 0 C--N 1.32 -0.703 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.603 174.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 C--O 1.224 -0.278 0 CA-C-O 121.51 0.672 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.407 ' O ' ' HB3' ' A' 1018 ' ' LYS . 12.1 tp60 -61.01 -38.47 86.2 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.528 -173.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -58.53 -36.15 73.42 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.401 -0.52 . . . . 0.0 111.406 171.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.71 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 0.7 OUTLIER -70.22 -23.36 62.92 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.416 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.714 ' HE2' HD12 ' A' ' 943' ' ' ILE . 64.6 tttm -80.33 -25.05 39.49 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.564 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -74.71 -54.14 7.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -53.1 -32.15 45.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.657 170.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.679 ' HG3' ' SD ' ' A' 1002 ' ' MET . 33.1 ttp -57.02 -49.0 77.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.591 175.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -64.02 -49.92 70.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -60.08 -37.57 80.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.147 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -73.78 -40.07 63.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.478 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.28 -34.85 79.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.614 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.541 ' O ' HG23 ' A' 1030 ' ' VAL . 76.4 t60 -74.28 -38.6 63.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.52 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.62 83.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 173.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.879 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -56.56 -46.04 80.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.007 176.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.552 ' O ' ' HG3' ' A' 1033 ' ' LYS . . . -55.67 -30.85 61.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.478 176.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' 1026 ' ' HIS . 57.7 t -71.94 -33.0 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.663 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 1.1 m-20 -51.77 -47.71 64.05 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.505 0.669 . . . . 0.0 109.3 172.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.988 ' HB2' HD11 ' A' ' 932' ' ' LEU . . . -66.46 -48.55 69.55 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.76 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.592 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 89.1 mttt -60.6 -39.67 88.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.716 -174.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.632 ' O ' HG21 ' A' 1038 ' ' VAL . 65.5 t30 -71.26 -36.95 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.034 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.753 ' O ' HG12 ' A' 1039 ' ' ILE . 20.4 tp -77.84 -29.4 50.5 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.544 -177.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.859 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -68.35 -24.86 64.86 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.428 ' O ' ' HG3' ' A' 1041 ' ' GLN . 38.6 t70 -81.8 -45.47 15.54 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.864 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.831 HG23 ' HG3' ' A' ' 983' ' ' GLU . 24.5 t -53.89 -62.16 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.806 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.753 HG12 ' O ' ' A' 1035 ' ' LEU . 8.2 pt -84.0 -27.46 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -173.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.607 ' O ' ' HG3' ' A' 1043 ' ' ARG . 26.5 t70 -61.06 -30.8 70.54 Favored 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 118.145 -1.422 . . . . 0.0 108.893 163.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.53 ' O ' ' HD3' ' A' 1045 ' ' LYS . 73.6 mt-30 -79.76 -24.04 41.81 Favored 'General case' 0 C--O 1.203 -1.394 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.677 169.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.623 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -58.22 -52.63 64.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.331 0.586 . . . . 0.0 109.822 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 1.107 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 6.5 ppt_? -57.3 -32.09 66.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.677 176.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.423 ' N ' ' HD2' ' A' 1043 ' ' ARG . 51.7 tp -78.95 -29.68 44.16 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.177 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.695 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 12.0 mptt -61.52 -43.23 99.23 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.684 0.793 . . . . 0.0 110.167 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.1 ttt -64.33 -35.03 79.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.567 176.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.483 HG12 ' O ' ' A' 1043 ' ' ARG . 45.6 mm -70.72 -43.54 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.914 174.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.5 m -51.74 -33.01 32.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.014 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1049 ' ' GLN . . . . . 0.411 ' HA ' ' OE1' ' A' 1049 ' ' GLN . 6.8 tp60 . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.682 0.277 . . . . 0.0 111.042 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.496 ' C ' ' H ' ' A' ' 922' ' ' ASN . 25.0 tpt180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 63.9 m 68.92 -1.71 1.97 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.563 0.697 . . . . 0.0 110.626 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.864 ' OD1' ' HA ' ' A' 1040 ' ' ASP . 0.4 OUTLIER 64.77 74.66 0.39 Allowed 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 114.364 -1.289 . . . . 0.0 113.952 174.436 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.535 ' CG ' ' H ' ' A' ' 924' ' ' LYS . 37.1 t70 -48.88 -173.77 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 111.907 -2.406 . . . . 0.0 113.277 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.641 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.0 tmtp? -41.08 -14.52 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.617 1.167 . . . . 0.0 112.88 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.756 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.5 m -63.6 -51.58 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 C-N-CA 122.959 0.503 . . . . 0.0 112.042 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.751 ' HB2' ' OD1' ' A' ' 922' ' ' ASN . 49.0 t80 -75.49 -34.12 60.85 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.257 1.027 . . . . 0.0 108.384 -178.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 40.5 mt-10 -64.94 -58.7 5.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 113.475 -1.693 . . . . 0.0 112.59 -176.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.641 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 3.6 t-20 -73.36 -31.02 63.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -171.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.711 ' CG2' HD13 ' A' 1039 ' ' ILE . 22.7 t -68.28 -35.86 72.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.793 176.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 90.5 m -56.86 -25.31 56.29 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.553 0.692 . . . . 0.0 109.969 163.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . 0.46 ' HA2' ' HG2' ' A' ' 934' ' ' LYS . . . -71.84 -26.88 71.76 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.526 176.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.72 HD12 HD11 ' A' ' 965' ' ' LEU . 6.4 tt -61.93 -41.35 97.84 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 172.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.636 ' O ' HG12 ' A' ' 937' ' ' ILE . 45.0 t -61.06 -45.2 99.03 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.979 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.487 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.3 mmpt? -54.67 -44.49 73.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.551 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.682 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.01 -28.65 60.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.7 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.577 ' HA ' HG13 ' A' ' 958' ' ' VAL . 8.8 p -77.62 -18.38 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 119.869 -0.732 . . . . 0.0 109.629 174.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.636 HG12 ' O ' ' A' ' 933' ' ' VAL . 34.8 mm -67.95 -26.08 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 169.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.545 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 35.5 mm-40 -64.9 -42.47 94.74 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.322 173.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.707 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.6 ptt? -55.64 -42.14 74.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.331 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.476 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 9.7 p -75.07 -35.22 61.85 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 12.1 p -77.6 -48.95 15.63 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.264 0.554 . . . . 0.0 111.067 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -68.64 -22.19 64.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.386 -176.169 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.672 ' HA ' ' HB2' ' A' ' 946' ' ' ALA . 10.4 tp -79.89 -22.75 11.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.669 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.68 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 33.7 mm-40 -49.3 -54.97 24.44 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.826 -0.17 . . . . 0.0 110.96 175.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 76.2 Cg_endo -95.24 30.22 0.21 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.614 1.543 . . . . 0.0 113.2 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.861 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -133.11 153.26 80.76 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -173.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.652 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.9 Cg_endo -92.88 -175.23 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.025 3.15 . . . . 0.0 111.968 174.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.904 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 9.7 Cg_endo -53.17 -30.53 51.01 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.875 2.384 . . . . 0.0 112.836 176.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -57.66 -29.52 64.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.061 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.861 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 48.9 mm-40 -102.02 0.86 35.76 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.088 0.243 . . . . 0.0 111.198 175.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.904 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 1.7 m-85 -59.26 -44.03 92.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -74.78 -48.09 4.93 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.392 176.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.7 Cg_exo -55.77 -23.63 42.56 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 121.696 1.598 . . . . 0.0 114.596 172.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.728 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 22.2 ptt? -73.32 -36.44 66.23 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.114 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 1.004 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -66.63 -27.22 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.085 172.763 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 83.1 tttt -55.15 -42.1 72.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 175.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.86 -47.44 71.0 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.462 173.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.59 HG22 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -68.47 -23.59 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.223 176.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.535 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -66.26 -42.69 94.01 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.475 HD22 ' HD2' ' A' ' 963' ' ' ARG . 84.5 mt -70.27 -10.27 58.43 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.27 0.557 . . . . 0.0 110.362 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.709 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -78.83 -56.24 4.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.925 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.667 HD12 ' HB3' ' A' ' 991' ' ' LEU . 2.6 tt -66.67 -29.06 68.99 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.285 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.475 ' HD2' HD22 ' A' ' 960' ' ' LEU . 54.9 mtt-85 -59.56 -61.42 2.63 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.069 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 5.3 m -56.1 -30.66 62.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.059 0.457 . . . . 0.0 110.95 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.72 HD11 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -67.12 -41.43 86.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.912 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -52.91 -35.48 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.377 174.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -60.91 -49.4 77.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.142 0.496 . . . . 0.0 110.068 175.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.756 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.2 m -58.24 -42.86 87.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.775 171.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.717 HG12 HD12 ' A' ' 984' ' ' ILE . 53.3 t -54.42 -30.96 22.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.422 0.153 . . . . 0.0 111.168 174.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.599 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 19.3 t70 -71.62 -26.09 62.43 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 177.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.529 ' O ' HG22 ' A' ' 975' ' ' VAL . 39.1 mm-40 -69.09 -44.89 71.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.383 1.087 . . . . 0.0 108.889 169.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.591 ' OG ' HG23 ' A' ' 980' ' ' THR . 33.4 t -66.36 -24.56 66.52 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.857 178.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.5 OUTLIER -60.71 -52.98 68.73 Favored Pre-proline 0 C--O 1.214 -0.783 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.639 -177.264 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.606 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 10.5 Cg_endo -58.71 -26.82 81.29 Favored 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.676 1.634 . . . . 0.0 111.373 170.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.58 HG21 ' HE1' ' A' 1046 ' ' MET . 2.1 t -75.82 -15.9 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.527 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.995 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -64.53 -52.68 50.73 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.695 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.634 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 31.5 Cg_exo -62.71 -30.26 78.25 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 121.409 1.406 . . . . 0.0 111.084 175.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.27 -57.33 10.8 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.173 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.776 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 17.1 m -165.49 -36.36 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.242 0.544 . . . . 0.0 112.194 -174.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.791 HG21 ' HB ' ' A' ' 984' ' ' ILE . 70.7 m -56.18 -22.71 30.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -173.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.995 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 24.7 p-80 -51.05 -30.02 14.45 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.054 0.843 . . . . 0.0 112.808 -172.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 40.3 mtm105 -62.28 -55.39 28.7 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.927 -0.709 . . . . 0.0 111.532 173.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.77 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.47 -47.29 23.44 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.471 -0.491 . . . . 0.0 112.198 -174.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.791 ' HB ' HG21 ' A' ' 980' ' ' THR . 13.0 tt -55.27 -37.97 45.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.429 -172.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 2.9 pp20? -73.28 -31.7 64.22 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.181 -178.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.727 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 18.0 ptp -62.54 -56.76 14.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.218 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.11 -33.16 44.62 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.804 ' HA ' HD11 ' A' ' 991' ' ' LEU . 57.7 tt0 -60.43 -44.69 95.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.306 -178.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.564 ' HG3' ' O ' ' A' ' 985' ' ' GLU . 28.0 mtmm -64.73 -34.04 77.39 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.525 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 3.0 tp -64.12 -46.31 84.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.495 177.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.02 HD13 ' HG ' ' A' 1035 ' ' LEU . 13.2 mt -54.51 -60.14 3.76 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.075 0.464 . . . . 0.0 110.568 175.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -50.99 -43.03 60.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.241 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.561 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 42.0 t -62.35 -56.94 13.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.957 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.433 ' O ' HD23 ' A' ' 998' ' ' LEU . 1.8 m-20 -83.15 -42.89 16.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -168.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.895 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.8 OUTLIER -53.1 -55.1 26.55 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.812 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.679 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -54.75 -43.82 73.04 Favored 'General case' 0 N--CA 1.46 0.067 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 174.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.734 ' O ' ' HG2' ' A' 1001 ' ' LYS . 36.5 mt-10 -54.24 -43.29 70.77 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.241 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.717 ' O ' ' HG2' ' A' 1002 ' ' MET . 4.1 mm? -63.64 -36.47 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.049 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.869 ' HA ' HG13 ' A' ' 955' ' ' VAL . 11.1 pt -71.04 -7.87 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 119.99 -0.684 . . . . 0.0 109.972 -177.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.721 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 13.7 m-80 -113.13 -15.3 12.8 Favored 'General case' 0 C--O 1.207 -1.145 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.734 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 21.8 mmmt -73.75 -32.73 63.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.004 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 12.3 mmt -78.55 -42.02 30.46 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.721 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 16.1 tppt? -55.4 -45.18 76.66 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.206 169.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.408 ' HA ' HD21 ' A' 1004 ' ' LEU . 14.6 mt -61.51 -48.21 82.1 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.687 0.617 . . . . 0.0 112.286 175.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.78 -44.1 86.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.169 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.48 -16.56 59.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.841 178.12 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.678 ' HB2' ' O ' ' A' 1003 ' ' LYS . 7.6 tp-100 -81.42 -36.72 29.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.315 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.578 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.2 t80 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.332 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.531 0.23 0 CA-C-O 120.588 0.233 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.96 -31.6 65.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' 1020 ' ' GLN . 34.8 tt0 -54.46 -54.31 42.63 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.849 170.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.578 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-85 -60.21 -35.88 76.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.007 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -62.12 -36.34 81.48 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.597 0.237 . . . . 0.0 110.974 171.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.485 ' HB3' ' O ' ' A' 1016 ' ' GLU . 14.5 tppt? -63.28 -54.9 30.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.041 0.448 . . . . 0.0 110.063 175.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' 1016 ' ' GLU . 6.8 mm-40 -51.3 -37.77 49.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.212 173.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1021 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -65.69 -41.8 91.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.122 177.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 69.8 mt -60.5 -44.25 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 111.408 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.8 m -66.04 -46.7 76.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.232 0.539 . . . . 0.0 110.229 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.63 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -62.28 -43.41 98.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.191 178.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.475 ' N ' HD13 ' A' ' 998' ' ' LEU . . . -60.39 -31.57 70.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.775 0.321 . . . . 0.0 111.009 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.597 ' O ' HG22 ' A' 1030 ' ' VAL . 12.2 t-80 -75.76 -35.69 60.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.575 -0.45 . . . . 0.0 109.847 176.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.39 94.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.895 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.8 tt -56.29 -55.82 28.58 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.605 0.717 . . . . 0.0 111.004 171.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -52.98 -28.79 25.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.005 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' 1026 ' ' HIS . 77.4 t -74.11 -41.64 51.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 119.619 -0.229 . . . . 0.0 111.519 173.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.736 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -61.53 -46.93 87.85 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.09 177.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.525 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -53.77 -40.46 66.25 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.79 169.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' 1036 ' ' LEU . 88.6 tttt -77.37 -35.04 54.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.424 0.631 . . . . 0.0 110.246 -172.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.444 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -75.41 -45.57 38.1 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.988 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 1.02 ' HG ' HD13 ' A' ' 991' ' ' LEU . 3.4 tm? -67.99 -33.68 75.09 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.96 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.611 ' O ' ' HB2' ' A' 1040 ' ' ASP . 4.2 pp -64.74 -29.34 70.32 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.451 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 20.8 t70 -84.98 -37.67 20.17 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.887 0.742 . . . . 0.0 109.511 178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.77 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 5.7 t -52.88 -52.97 23.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.654 172.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.805 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 24.4 pt -90.48 -22.77 6.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.864 ' HA ' ' OD1' ' A' ' 922' ' ' ASN . 6.2 t70 -44.81 -49.26 10.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 157.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 28.3 mt-30 -78.44 -27.33 46.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.481 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.805 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.68 -56.12 22.53 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 118.333 0.515 . . . . 0.0 111.46 175.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.603 ' HB2' HG23 ' A' ' 925' ' ' VAL . 0.1 OUTLIER -57.82 -32.3 67.45 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.336 176.49 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.87 -13.1 59.99 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.762 174.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.776 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.7 mmtp -73.24 -35.47 66.26 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.58 ' HE1' HG21 ' A' ' 975' ' ' VAL . 59.8 ttm -66.42 -40.65 89.66 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.669 173.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.03 -35.0 62.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.794 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 22.3 t -70.12 -33.87 72.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.02 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 21.9 tp60 . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.743 -178.464 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.657 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 2.1 tpm_? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 35.2 t 73.53 -0.24 3.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.035 0.534 . . . . 0.0 111.668 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.4 OUTLIER 52.54 68.75 0.78 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-O 121.598 0.714 . . . . 0.0 111.247 175.12 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 925' ' ' VAL . 45.3 t0 -45.1 -171.78 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 112.105 -2.316 . . . . 0.0 112.687 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.3 tmtp? -34.9 -21.44 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.392 1.077 . . . . 0.0 113.007 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.832 HG23 ' HB2' ' A' 1043 ' ' ARG . 0.5 OUTLIER -56.36 -56.17 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 172.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -78.02 -30.54 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.156 0.979 . . . . 0.0 108.527 -177.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.637 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 86.4 mt-10 -60.31 -50.92 71.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.978 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.483 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 32.3 t-20 -66.1 -44.46 84.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.346 -174.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.571 ' HB ' ' HB3' ' A' 1036 ' ' LEU . 4.1 t -62.44 -30.97 50.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.057 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.533 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 56.4 m -64.05 -34.77 78.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.881 0.848 . . . . 0.0 109.146 171.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.95 -28.0 62.94 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.85 172.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.967 HD13 HD12 ' A' ' 965' ' ' LEU . 3.7 tt -66.92 -49.17 66.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 117.455 0.627 . . . . 0.0 109.745 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.547 ' O ' HG12 ' A' ' 937' ' ' ILE . 3.4 m -63.01 -32.24 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.895 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.533 ' HD2' ' O ' ' A' ' 930' ' ' THR . 1.3 mpmm? -65.07 -28.41 69.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.854 0.359 . . . . 0.0 110.994 174.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.624 ' CB ' ' HB3' ' A' ' 961' ' ' ALA . . . -82.14 -26.03 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 0.0 111.265 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.543 HG13 ' HA ' ' A' ' 933' ' ' VAL . 9.7 p -80.81 -10.43 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.124 172.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.7 mm -71.86 -36.87 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 166.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.536 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 41.2 mt-10 -57.74 -45.05 86.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.668 170.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.547 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.2 -45.2 91.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.682 176.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.72 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.9 t -64.27 -37.98 89.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.308 -177.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.542 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.5 p -77.11 -38.87 51.3 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 -176.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.611 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.7 mmtp -52.87 -49.96 64.79 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.683 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.724 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.2 tt -71.1 -23.74 23.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.799 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 84.7 mm-40 -59.38 -64.75 2.6 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -175.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.799 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -101.29 5.55 0.59 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.667 1.578 . . . . 0.0 113.832 -174.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -110.62 157.22 38.98 Favored Pre-proline 0 C--N 1.323 -0.572 0 C-N-CA 120.627 -0.429 . . . . 0.0 112.098 -173.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.99 176.37 9.46 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.417 2.744 . . . . 0.0 112.237 177.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.728 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.7 Cg_exo -53.29 -24.93 28.72 Favored 'Trans proline' 0 C--O 1.245 0.863 0 C-N-CA 123.318 2.679 . . . . 0.0 113.289 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -54.55 -31.27 56.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.097 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.546 ' OE1' ' HE2' ' A' ' 942' ' ' LYS . 10.7 mm-40 -100.96 1.18 39.48 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.323 178.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.728 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 13.7 m-30 -64.27 -39.01 93.07 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 172.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.044 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -73.18 -51.22 6.08 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.591 174.856 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.967 ' HD3' HG12 ' A' ' 952' ' ' VAL . 84.3 Cg_exo -51.62 -36.86 62.24 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.157 1.905 . . . . 0.0 114.742 172.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.724 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 26.4 ptt? -62.71 -46.99 85.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.394 0.616 . . . . 0.0 110.054 -177.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.594 ' O ' HG21 ' A' ' 958' ' ' VAL . 89.4 t -68.21 -26.55 34.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 173.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 87.3 tttt -58.75 -38.11 77.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 6.1 mm-40 -55.37 -46.88 76.45 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.855 174.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.594 HG21 ' O ' ' A' ' 955' ' ' VAL . 2.5 m -74.24 -22.35 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 O-C-N 122.202 -0.311 . . . . 0.0 111.829 177.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.512 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.48 -44.0 66.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.135 -1.031 . . . . 0.0 111.479 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.42 -27.78 69.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.588 0.232 . . . . 0.0 110.768 171.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.676 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -58.62 -56.91 16.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.218 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 991' ' ' LEU . 5.1 tt -63.03 -36.57 84.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.191 -0.204 . . . . 0.0 111.057 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 46.1 ttt180 -59.85 -53.47 57.51 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 176.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.8 m -55.92 -40.9 73.76 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.848 0.832 . . . . 0.0 109.914 174.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.967 HD12 HD13 ' A' ' 932' ' ' LEU . 2.2 tt -60.78 -29.51 69.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.851 176.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.1 tp -68.03 -29.56 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.549 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.33 -38.33 90.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.352 0.596 . . . . 0.0 109.668 173.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.71 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.3 m -71.2 -33.69 70.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.101 174.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 965' ' ' LEU . 78.6 t -55.12 -30.99 24.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.537 171.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.476 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.6 t70 -77.87 -26.23 49.12 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 177.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.544 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.5 mm-40 -65.91 -54.25 28.93 Favored 'General case' 0 C--O 1.25 1.079 0 CA-C-O 123.344 1.545 . . . . 0.0 108.514 170.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 46.6 t -62.84 -26.94 69.0 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.657 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.785 ' HA ' HD12 ' A' ' 976' ' ' LEU . 4.9 tt -57.33 -52.99 70.09 Favored Pre-proline 0 N--CA 1.472 0.674 0 CA-C-O 118.597 -0.716 . . . . 0.0 112.421 -174.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 51.7 Cg_exo -55.19 -30.75 72.82 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.178 1.456 . . . . 0.0 110.541 170.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.562 HG11 ' HG1' ' A' ' 980' ' ' THR . 2.6 t -77.05 -13.71 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.618 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.855 ' HG ' HG23 ' A' ' 984' ' ' ILE . 5.8 mp -61.72 -64.45 3.07 Favored Pre-proline 0 N--CA 1.472 0.66 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.8 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.71 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 17.3 Cg_endo -58.21 -28.19 83.24 Favored 'Trans proline' 0 C--N 1.364 1.361 0 C-N-CA 121.505 1.47 . . . . 0.0 111.291 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . 0.619 ' O ' ' HG3' ' A' 1049 ' ' GLN . . . -59.52 -52.2 66.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.513 173.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 1.071 ' HB3' ' HB3' ' A' 1045 ' ' LYS . 3.5 t -171.58 -33.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.034 0.445 . . . . 0.0 112.044 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.973 HG21 ' HB ' ' A' ' 984' ' ' ILE . 18.0 m -63.81 -22.19 66.79 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -172.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.452 ' HA ' HG21 ' A' ' 984' ' ' ILE . 15.8 t-80 -53.21 -21.56 5.38 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -175.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -76.1 -54.78 6.33 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.162 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.743 ' CG ' HG22 ' A' 1038 ' ' VAL . 3.4 tp10 -74.49 -43.14 57.35 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.426 -0.509 . . . . 0.0 111.374 -178.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.973 ' HB ' HG21 ' A' ' 980' ' ' THR . 0.2 OUTLIER -59.45 -37.71 71.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -174.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.27 -43.88 83.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.543 174.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.677 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.8 ptm -63.02 -47.91 81.04 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.143 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.874 ' HB3' HG21 ' A' 1038 ' ' VAL . . . -79.44 -43.54 23.09 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.829 ' HA ' HD11 ' A' ' 991' ' ' LEU . 61.5 tt0 -60.27 -45.98 91.42 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.974 -0.291 . . . . 0.0 111.544 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -66.54 -31.02 71.47 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -40.39 91.36 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.359 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.012 HD13 HD23 ' A' 1035 ' ' LEU . 18.5 mt -58.07 -56.28 24.13 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.519 0.676 . . . . 0.0 110.557 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.99 -31.8 63.36 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.75 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.5 m -76.07 -36.34 59.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.838 -177.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -102.55 -31.47 10.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.06 -174.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.84 ' HA ' HD13 ' A' 1028 ' ' LEU . 1.5 tm? -59.41 -41.25 89.06 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 168.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.63 93.37 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.152 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.507 ' O ' ' HD3' ' A' 1001 ' ' LYS . 19.2 mm-40 -53.14 -43.33 66.9 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.681 173.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.845 HD13 HD11 ' A' 1028 ' ' LEU . 2.4 mt -67.26 -28.97 68.47 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.74 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.709 HG23 ' HE1' ' A' 1002 ' ' MET . 44.0 mm -66.23 -43.21 91.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.837 177.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.2 m-20 -79.31 -15.2 58.31 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.853 177.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -87.17 -36.83 17.81 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.204 0.315 . . . . 0.0 111.371 178.464 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.044 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -65.71 -39.48 91.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 169.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 58.9 tttm -62.56 -53.31 56.54 Favored 'General case' 0 C--O 1.204 -1.322 0 CA-C-N 114.021 -1.445 . . . . 0.0 108.511 174.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.595 ' HG ' ' HB3' ' A' 1017 ' ' TYR . 21.5 tp -49.29 -56.38 9.64 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.352 1.061 . . . . 0.0 113.489 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.84 -45.85 89.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.479 0.657 . . . . 0.0 110.18 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.467 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.4 pp0? -76.54 -11.06 59.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.086 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -81.27 -40.31 23.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.267 -176.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.552 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 11.7 m-85 . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.807 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.49 ' HA ' ' HD2' ' A' 1017 ' ' TYR . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -55.07 -34.83 63.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.541 ' HG2' ' CE1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -48.05 -50.31 28.43 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.825 0.821 . . . . 0.0 110.882 168.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.595 ' HB3' ' HG ' ' A' 1004 ' ' LEU . 14.5 m-85 -78.98 -20.06 50.08 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.668 -175.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.492 ' O ' ' HG ' ' A' 1022 ' ' LEU . 19.0 ttmm -72.34 -33.13 67.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.211 169.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.42 ' HB3' ' HE3' ' A' 1019 ' ' LYS . 20.6 mmmt -74.42 -56.67 4.59 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.566 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' 1016 ' ' GLU . 44.2 mt-30 -50.8 -31.7 17.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.471 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 14.9 tmm? -67.85 -45.95 73.14 Favored 'General case' 0 C--O 1.23 0.06 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.266 175.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' 1018 ' ' LYS . 95.8 mt -60.54 -40.14 90.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.874 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 24.8 m -62.59 -34.17 76.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 0.0 110.582 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.42 -42.04 31.23 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.069 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.496 ' HA ' HD12 ' A' ' 998' ' ' LEU . . . -61.83 -38.43 88.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.05 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.597 ' O ' HG22 ' A' 1030 ' ' VAL . 19.0 t-80 -69.08 -47.92 64.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.375 178.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.14 -34.94 75.8 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.441 0.463 . . . . 0.0 110.427 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.845 HD11 HD13 ' A' ' 998' ' ' LEU . 0.7 OUTLIER -63.12 -50.05 72.0 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.685 0.755 . . . . 0.0 110.385 174.688 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.56 -37.53 68.13 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.053 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' 1026 ' ' HIS . 57.2 t -67.57 -30.57 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.695 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -75.14 -39.35 60.55 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.711 -0.795 . . . . 0.0 109.029 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.406 ' HB2' HD21 ' A' ' 932' ' ' LEU . . . -62.19 -53.16 59.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.19 172.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.508 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 27.0 mtpp -61.89 -39.73 92.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.814 -177.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.629 ' O ' HG23 ' A' 1038 ' ' VAL . 7.4 t30 -68.55 -38.01 80.43 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.111 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 1.012 HD23 HD13 ' A' ' 991' ' ' LEU . 15.4 tp -78.36 -26.08 46.56 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.09 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.571 ' HB3' ' HB ' ' A' ' 929' ' ' VAL . 4.4 pp -74.11 -21.57 59.84 Favored 'General case' 0 C--O 1.211 -0.944 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' A' 1041 ' ' GLN . 3.9 m-20 -82.23 -46.53 13.59 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 123.967 0.792 . . . . 0.0 109.163 170.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.874 HG21 ' HB3' ' A' ' 987' ' ' ALA . 29.0 t -50.6 -57.07 2.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.482 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.794 ' CG2' ' HB ' ' A' ' 925' ' ' VAL . 17.2 mt -73.36 -35.97 47.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.95 -177.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' 1036 ' ' LEU . 5.0 t70 -50.98 -45.46 60.96 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 166.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.634 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.9 mt-30 -72.57 -29.34 63.45 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.09 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.591 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -54.03 -58.03 8.82 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 121.043 0.449 . . . . 0.0 111.777 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.832 ' HB2' HG23 ' A' ' 925' ' ' VAL . 0.6 OUTLIER -59.51 -28.83 67.41 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.356 177.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 40.1 tp -77.42 -25.82 51.1 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.451 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 1.071 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 3.6 mmpm? -63.33 -33.59 75.86 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.855 0.836 . . . . 0.0 109.091 175.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.9 ttt -64.72 -43.6 92.91 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.301 -1.318 . . . . 0.0 109.275 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.484 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.1 mm -60.85 -43.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.0 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' 1045 ' ' LYS . 66.3 m -53.97 -29.61 43.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.219 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1049 ' ' GLN . . . . . 0.619 ' HG3' ' O ' ' A' ' 978' ' ' ALA . 26.5 mm-40 . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -176.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.938 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 38.2 m 74.27 22.75 2.17 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.888 0.742 . . . . 0.0 111.034 -174.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.938 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 44.02 55.65 5.2 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.999 176.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 925' ' ' VAL . 14.0 m-20 -46.52 -175.15 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.487 0 O-C-N 125.121 1.513 . . . . 0.0 112.582 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.528 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 5.4 tmtp? -33.06 -24.76 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.667 1.187 . . . . 0.0 113.243 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.789 HG22 ' HB2' ' A' 1043 ' ' ARG . 4.9 m -61.85 -53.38 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-O 119.194 -0.431 . . . . 0.0 112.081 175.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.61 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 71.2 t80 -78.4 -27.29 46.69 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.5 mt-10 -64.97 -61.12 2.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.901 -178.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.528 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -70.02 -34.53 73.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.11 -172.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.937 ' HB ' HD11 ' A' 1039 ' ' ILE . 12.7 p -62.36 -34.76 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.816 175.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.531 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -68.1 -35.36 78.03 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.94 -28.39 63.46 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.416 172.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 5.5 tt -63.39 -42.93 98.83 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 175.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.575 ' O ' HG12 ' A' ' 937' ' ' ILE . 42.4 t -63.97 -38.12 81.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.263 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.547 ' HA ' ' HE2' ' A' ' 934' ' ' LYS . 10.5 mmpt? -65.11 -33.95 77.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.992 0.425 . . . . 0.0 110.469 177.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.722 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . . . -76.2 -26.13 55.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.338 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.644 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -83.38 -14.14 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.673 173.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.575 HG12 ' O ' ' A' ' 933' ' ' VAL . 39.7 mm -70.08 -35.79 65.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 166.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.614 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 46.5 mt-10 -54.35 -43.65 71.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.365 170.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.619 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.2 ttp -58.46 -43.59 88.93 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.596 0.56 . . . . 0.0 110.356 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.572 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 16.7 m -65.6 -37.18 85.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.093 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.489 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.6 m -77.3 -43.06 34.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -177.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.681 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.4 mmtm -49.94 -57.65 7.05 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.601 -1.636 . . . . 0.0 111.259 176.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.88 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 12.9 tt -62.5 -29.27 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.767 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.5 mt-30 -50.29 -60.69 4.8 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.767 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 18.1 Cg_endo -93.37 0.94 3.44 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.499 1.466 . . . . 0.0 113.879 177.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.882 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -90.16 148.43 39.3 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.57 175.34 6.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.902 3.068 . . . . 0.0 110.064 165.153 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.611 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 9.9 Cg_endo -51.87 -31.01 40.94 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.742 2.295 . . . . 0.0 112.511 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.54 -33.27 67.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.081 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.882 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 1.3 mp0 -98.73 -0.27 43.11 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 122.953 0.158 . . . . 0.0 111.297 175.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.705 ' O ' ' HG2' ' A' ' 954' ' ' MET . 10.1 m-30 -65.55 -37.84 87.88 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 175.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.046 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -78.42 -45.16 2.08 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.163 173.447 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.046 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.4 Cg_exo -53.81 -28.43 47.94 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.829 1.686 . . . . 0.0 113.999 170.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.912 ' HE3' ' HE2' ' A' 1002 ' ' MET . 16.6 ptt? -72.87 -37.89 67.21 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.465 178.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.78 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -64.82 -26.49 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.702 171.494 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.679 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 55.7 tttt -57.0 -40.77 77.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -55.67 -46.17 77.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.49 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 936' ' ' VAL . 1.6 m -72.77 -22.7 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 120.798 0.332 . . . . 0.0 111.179 176.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.528 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.28 -44.27 66.56 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.175 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.78 -24.07 67.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.948 172.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.722 ' HB1' ' HB3' ' A' ' 935' ' ' ALA . . . -61.1 -57.82 10.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.324 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.665 ' HB2' HD11 ' A' ' 995' ' ' LEU . 22.8 tp -68.71 -34.42 75.61 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.637 -0.425 . . . . 0.0 112.016 178.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 959' ' ' GLY . 75.1 mtp180 -59.57 -55.23 37.1 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.772 -0.58 . . . . 0.0 112.437 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.427 HG22 ' OD1' ' A' ' 928' ' ' ASN . 14.7 m -57.88 -34.7 70.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.584 0.707 . . . . 0.0 110.242 174.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.657 HD11 HD13 ' A' ' 962' ' ' LEU . 3.0 tm? -63.81 -29.0 70.24 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.235 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.463 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 0.2 OUTLIER -66.94 -28.16 68.06 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.687 -178.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.06 89.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.381 0.61 . . . . 0.0 109.836 172.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.738 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.3 m -58.55 -39.68 80.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.61 172.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.522 HG12 HD12 ' A' ' 984' ' ' ILE . 72.7 t -54.07 -30.55 20.22 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.307 174.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.485 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.2 t70 -74.65 -24.06 58.77 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.6 mm-40 -71.91 -51.22 23.28 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.83 1.3 . . . . 0.0 109.135 169.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.661 ' HG ' HG22 ' A' ' 980' ' ' THR . 30.9 t -65.45 -24.56 67.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.803 -1.544 . . . . 0.0 111.056 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.644 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 28.4 tp -63.76 -50.17 72.61 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-O 118.468 -0.777 . . . . 0.0 112.454 -175.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.8 Cg_exo -59.23 -26.49 81.98 Favored 'Trans proline' 0 C--N 1.356 0.964 0 CA-C-N 121.096 1.427 . . . . 0.0 110.827 169.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.589 HG12 ' O ' ' A' 1042 ' ' ALA . 38.7 t -75.09 -16.71 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.726 174.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.782 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 0.3 OUTLIER -64.57 -54.85 33.78 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.81 176.231 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.548 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 29.2 Cg_exo -62.2 -25.61 77.09 Favored 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 120.962 1.379 . . . . 0.0 110.406 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -68.11 -61.6 1.78 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.656 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.841 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 9.6 m -163.45 -50.22 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -172.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.661 HG22 ' HG ' ' A' ' 972' ' ' SER . 4.9 t -53.28 -15.99 1.15 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -172.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.782 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 8.9 p-80 -47.94 -20.78 0.35 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.425 ' HA ' ' HD2' ' A' ' 982' ' ' ARG . 9.1 tpt180 -76.86 -52.24 9.83 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.465 -0.894 . . . . 0.0 110.488 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.988 ' HB3' HG11 ' A' 1038 ' ' VAL . 0.0 OUTLIER -76.61 -39.07 53.61 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.757 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.578 HG21 ' HA ' ' A' ' 981' ' ' HIS . 10.6 tt -63.06 -25.35 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.891 -176.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -73.5 -40.85 63.75 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.303 171.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.635 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 15.7 ptp -70.9 -51.2 27.63 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.842 -0.743 . . . . 0.0 112.052 -173.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.564 ' CB ' HG22 ' A' 1038 ' ' VAL . . . -78.76 -40.12 34.22 Favored 'General case' 0 C--O 1.217 -0.625 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 1.057 ' HA ' HD13 ' A' ' 991' ' ' LEU . 6.6 tt0 -61.56 -44.75 96.46 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.208 -177.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.43 -26.18 64.48 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.572 0.701 . . . . 0.0 109.136 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 8.6 tp -72.25 -37.35 69.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.823 178.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.057 HD13 ' HA ' ' A' ' 988' ' ' GLN . 8.4 mt -61.58 -53.42 56.5 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.982 176.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -57.03 -37.49 71.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.494 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 4.5 p -71.65 -38.03 70.75 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -176.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.609 ' HA ' ' HB3' ' A' ' 997' ' ' GLU . 4.3 m-20 -106.77 -31.13 8.54 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 119.529 -0.868 . . . . 0.0 112.825 -172.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.799 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.7 OUTLIER -59.79 -45.46 92.22 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.24 91.16 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.848 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' A' 1001 ' ' LYS . 7.7 tp10 -53.03 -41.07 64.36 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.056 174.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.611 HD23 HD11 ' A' 1028 ' ' LEU . 40.9 tp -68.31 -38.99 82.14 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.243 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.78 ' HA ' HG11 ' A' ' 955' ' ' VAL . 77.7 mt -57.57 -51.21 72.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.298 0.57 . . . . 0.0 110.64 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.631 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -78.47 -11.72 59.97 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.531 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.726 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 0.8 OUTLIER -84.42 -32.95 23.83 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.311 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.912 ' HE2' ' HE3' ' A' ' 954' ' ' MET . 43.7 mmm -78.71 -39.49 36.33 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.738 ' O ' ' HB2' ' A' 1007 ' ' GLN . 84.1 tttt -55.79 -51.01 68.91 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.536 -1.211 . . . . 0.0 108.488 169.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.7 tp -57.28 -46.2 83.33 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.48 96.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.385 0.612 . . . . 0.0 110.35 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.0 pp0? -76.68 -10.66 59.54 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.446 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.738 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.6 tp-100 -87.95 -16.71 33.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.408 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 60.9 t80 . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.951 -176.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.527 0.081 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.676 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 19.7 pt20 -61.69 -32.28 72.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.453 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -50.44 -42.87 54.75 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 111.602 0.223 . . . . 0.0 111.602 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.608 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 4.5 m-30 -84.6 -19.62 32.74 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.225 0.536 . . . . 0.0 110.219 178.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.676 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.7 tttm -75.37 -32.11 60.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.49 177.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -76.44 -41.2 48.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -48.46 -40.14 25.3 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.554 166.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.619 ' HB3' ' O ' ' A' 1018 ' ' LYS . 1.3 tmt? -57.22 -46.71 82.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.252 173.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.57 -38.4 89.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.36 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.1 m -68.51 -37.08 79.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.894 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.91 -41.57 36.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.643 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.557 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -63.05 -31.79 73.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.258 0.552 . . . . 0.0 110.497 178.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.462 ' O ' HG23 ' A' 1030 ' ' VAL . 6.0 t60 -71.64 -44.13 64.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.775 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.86 94.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.698 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.799 HD13 ' HA ' ' A' ' 995' ' ' LEU . 5.5 tt -55.63 -53.53 55.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.178 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.77 -31.09 64.27 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.573 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.752 ' HA ' ' HG2' ' A' 1033 ' ' LYS . 80.6 t -66.06 -43.51 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.867 174.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.476 ' CB ' HD21 ' A' ' 991' ' ' LEU . 8.4 m-20 -51.35 -46.4 62.68 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.05 0.452 . . . . 0.0 109.838 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.605 ' HB1' HD22 ' A' ' 932' ' ' LEU . . . -60.9 -53.25 59.54 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.117 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.752 ' HG2' ' HA ' ' A' 1030 ' ' VAL . 15.0 ptmm? -65.75 -32.14 73.52 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -174.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.667 ' O ' HG21 ' A' 1038 ' ' VAL . 4.8 t30 -73.43 -36.85 66.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.511 -0.475 . . . . 0.0 109.998 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.914 HD22 HD12 ' A' ' 991' ' ' LEU . 9.9 tp -79.81 -26.96 40.34 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.713 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.839 ' HA ' HG12 ' A' ' 929' ' ' VAL . 3.9 pp -64.79 -27.11 68.67 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.563 ' O ' ' HG2' ' A' 1041 ' ' GLN . 31.4 t70 -75.31 -45.91 36.7 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.219 -1.355 . . . . 0.0 108.921 170.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.988 HG11 ' HB3' ' A' ' 983' ' ' GLU . 55.7 t -53.31 -61.27 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.758 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.107 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.937 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.8 pt -81.33 -32.7 12.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -172.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.61 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 8.6 t0 -54.6 -44.53 73.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.201 166.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.65 ' O ' ' HG2' ' A' 1045 ' ' LYS . 27.3 pt20 -78.47 -22.61 47.27 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.852 177.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.614 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.58 -55.35 30.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 118.478 0.581 . . . . 0.0 110.064 169.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.789 ' HB2' HG22 ' A' ' 925' ' ' VAL . 7.0 tpt180 -55.56 -33.86 64.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.131 175.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.508 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 66.1 tp -76.56 -26.3 54.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.439 175.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.841 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 69.0 mmtt -64.24 -34.63 78.55 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.0 ttp -71.41 -40.87 70.22 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.804 -1.543 . . . . 0.0 109.203 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.476 ' HB ' HD12 ' A' 1044 ' ' LEU . 48.6 mm -62.32 -35.02 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.809 172.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 31.2 t -60.7 -40.19 91.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.316 -175.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 15.1 mm100 . . . . . 0 C--N 1.325 -0.457 0 C-N-CA 120.561 -0.455 . . . . 0.0 111.621 -177.0 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.819 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 6.7 tpt180 . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -75.73 39.88 0.18 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.757 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.776 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.1 OUTLIER 43.32 69.93 0.35 Allowed 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 124.229 1.011 . . . . 0.0 111.801 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 925' ' ' VAL . 2.1 t70 -47.02 -173.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 O-C-N 126.042 2.089 . . . . 0.0 113.058 -171.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 0.6 OUTLIER -46.54 -12.11 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.605 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.734 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -65.4 -54.65 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.751 171.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.45 ' CD1' ' HB2' ' A' 1040 ' ' ASP . 52.2 t80 -78.88 -29.13 44.21 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 122.144 0.973 . . . . 0.0 108.64 -176.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.508 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 38.5 mt-10 -65.41 -62.47 1.51 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.075 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.457 HD22 HG21 ' A' ' 964' ' ' THR . 57.3 t30 -71.56 -32.52 68.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.985 -170.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.863 HG23 HD12 ' A' ' 965' ' ' LEU . 14.4 p -60.6 -38.02 77.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.44 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 55.6 m -65.49 -32.85 74.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 172.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.82 -33.2 67.44 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.866 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.493 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 21.0 tp -62.7 -43.0 99.93 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 117.383 0.591 . . . . 0.0 109.43 174.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 937' ' ' ILE . 27.4 t -63.53 -42.08 94.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.689 176.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.569 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.9 mmpt? -65.27 -31.01 71.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.644 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.02 -25.14 43.27 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.479 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' A' ' 933' ' ' VAL . 14.7 p -81.99 -11.32 12.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 C-N-CA 119.728 -0.789 . . . . 0.0 109.228 171.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 46.5 mm -72.34 -36.19 54.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 165.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.6 mm-40 -53.15 -38.05 62.39 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.372 170.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.493 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 57.5 ttp -58.16 -45.45 87.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.793 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.599 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 48.3 m -65.46 -33.07 75.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.666 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.753 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.2 m -77.46 -37.03 52.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.986 0.898 . . . . 0.0 108.943 -177.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.2 mmtp -70.01 -29.7 66.82 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.901 -1.499 . . . . 0.0 111.671 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 1.049 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 15.4 tt -79.49 -23.29 12.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.318 0.58 . . . . 0.0 110.462 178.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 940' ' ' SER . 84.2 mm-40 -55.27 -56.02 33.2 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.753 ' HD3' ' O ' ' A' ' 941' ' ' SER . 13.4 Cg_endo -91.31 -4.08 4.35 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.766 1.644 . . . . 0.0 115.421 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.724 ' HB2' ' HB3' ' A' ' 950' ' ' GLU . . . -129.86 162.0 56.15 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.538 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 3.2 Cg_exo -80.61 -178.83 4.7 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 124.283 3.322 . . . . 0.0 110.908 168.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.936 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 5.9 Cg_endo -47.59 -18.37 0.9 Allowed 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 124.712 3.608 . . . . 0.0 115.689 -168.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.38 -4.18 1.73 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 170.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 1.049 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.1 OUTLIER -96.03 -27.87 14.9 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 173.155 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 1.063 ' HA ' ' HE3' ' A' ' 954' ' ' MET . 11.1 m-85 -43.53 -47.36 7.28 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.983 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -69.75 -59.58 4.48 Favored Pre-proline 0 CA--C 1.555 1.152 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.814 177.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.983 ' HD3' HG12 ' A' ' 952' ' ' VAL . 51.2 Cg_exo -59.33 -35.92 95.66 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.338 2.026 . . . . 0.0 114.873 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 1.063 ' HE3' ' HA ' ' A' ' 951' ' ' TYR . 24.0 ptt? -64.01 -47.61 79.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -177.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.658 ' HB ' ' HB3' ' A' 1002 ' ' MET . 72.0 t -66.32 -27.0 39.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.55 174.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 88.2 tttt -62.71 -38.34 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.5 mm-40 -54.04 -45.37 71.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.883 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.637 ' HB ' HD23 ' A' ' 998' ' ' LEU . 1.9 t -71.71 -22.61 21.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.022 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.587 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -72.62 -45.79 34.37 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.109 -178.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.03 -21.61 66.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.826 0.346 . . . . 0.0 110.483 171.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 958' ' ' VAL . . . -62.34 -56.91 13.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.995 178.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.873 HD11 ' HB3' ' A' ' 991' ' ' LEU . 8.3 tt -70.66 -27.26 63.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.195 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -54.51 45.12 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.022 170.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.457 HG21 HD22 ' A' ' 928' ' ' ASN . 24.8 m -53.89 -38.55 64.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.599 174.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.863 HD12 HG23 ' A' ' 929' ' ' VAL . 0.4 OUTLIER -64.33 -29.6 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.418 178.695 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.415 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 34.5 tp -63.97 -31.95 73.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.507 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.49 91.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.558 0.694 . . . . 0.0 110.045 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.734 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.9 m -62.99 -39.0 93.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.423 173.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.771 HG13 HD12 ' A' ' 984' ' ' ILE . 87.0 t -54.88 -31.73 25.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.286 174.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.501 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 0.9 OUTLIER -73.95 -23.19 59.46 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 176.62 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.629 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.4 mm-40 -67.62 -52.92 32.54 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 122.71 1.243 . . . . 0.0 109.001 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.405 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 9.6 p -66.8 -23.08 66.02 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.233 -1.348 . . . . 0.0 111.206 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.677 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 37.8 tp -55.76 -53.76 59.22 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-O 118.921 -0.561 . . . . 0.0 112.077 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 37.5 Cg_exo -61.09 -24.64 79.76 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.336 1.357 . . . . 0.0 111.246 170.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.646 HG12 ' HB ' ' A' ' 980' ' ' THR . 38.3 t -74.49 -13.94 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.334 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.974 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.3 tt -70.34 -53.16 10.72 Favored Pre-proline 0 C--O 1.234 0.27 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.407 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.494 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 33.9 Cg_exo -61.24 -25.5 80.71 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.178 1.252 . . . . 0.0 110.96 173.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.08 -64.97 0.77 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.22 174.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.4 m -163.46 -35.28 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -173.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.699 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 1.0 OUTLIER -61.47 -14.11 26.21 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -171.574 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.974 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 9.7 p-80 -50.15 -19.16 0.7 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -172.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.479 ' HE ' ' HA ' ' A' ' 982' ' ' ARG . 2.6 tpm_? -73.8 -52.72 12.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.58 176.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.902 ' HB3' HG12 ' A' 1038 ' ' VAL . 3.1 mp0 -77.05 -43.95 32.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.771 HD12 HG13 ' A' ' 969' ' ' VAL . 9.8 tp -56.97 -30.13 33.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.65 -174.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.71 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 10.5 mm-40 -73.02 -45.13 59.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.38 172.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.741 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 14.3 ptp -62.72 -54.41 39.61 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.648 -170.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.759 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -74.88 -35.55 62.3 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.14 -176.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.881 ' HA ' HD11 ' A' ' 991' ' ' LEU . 6.4 tp-100 -59.59 -40.27 86.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.716 -176.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 69.1 mmtt -61.24 -42.35 98.46 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.653 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -65.75 -38.3 88.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.292 179.129 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.881 HD11 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -61.8 -47.03 86.97 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.428 0.632 . . . . 0.0 109.888 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -57.81 -46.18 85.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.54 -177.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.7 p -70.81 -38.2 73.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.842 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.416 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 1.2 m-20 -91.42 -42.14 10.48 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -168.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.773 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.6 tm? -59.92 -40.45 88.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 171.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.48 69.63 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.97 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.416 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 9.8 pt-20 -68.71 -28.86 67.21 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.663 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.816 HD21 HD13 ' A' 1028 ' ' LEU . 1.1 tp -56.97 -49.56 75.32 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.523 175.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.635 ' O ' ' HG3' ' A' 1002 ' ' MET . 29.7 pt -73.55 -24.71 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 120.849 0.356 . . . . 0.0 111.471 -179.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.679 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.4 m-80 -87.12 -1.11 57.65 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 121.96 -0.463 . . . . 0.0 109.869 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.991 ' HD2' ' HA ' ' A' 1021 ' ' MET . 5.5 ttpm? -82.99 -37.42 24.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.957 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -73.57 -37.64 65.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 173.151 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.851 ' O ' ' HB2' ' A' 1007 ' ' GLN . 53.8 tptt -56.63 -57.84 10.64 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.37 171.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.776 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 10.7 tp -55.29 -55.26 33.49 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.4 81.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 110.723 -177.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.7 -13.26 60.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.526 0.679 . . . . 0.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.851 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.7 tp-100 -79.79 -31.6 40.81 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.107 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.557 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 67.0 t80 . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.12 -176.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 N--CA 1.453 -0.3 0 CA-C-O 120.852 0.358 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.771 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 26.2 tt0 -60.55 -32.42 71.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.107 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.29 -43.77 22.68 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.262 169.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.776 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 7.2 m-30 -87.07 -7.36 58.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.083 0.468 . . . . 0.0 110.495 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.771 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 30.3 tptt -75.64 -26.41 57.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.654 169.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 67.7 mttm -72.35 -57.24 4.36 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -47.97 -35.56 11.02 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.471 169.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.991 ' HA ' ' HD2' ' A' 1001 ' ' LYS . 7.9 tpt -51.68 -48.69 63.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.263 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.54 -53.4 23.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.647 0.26 . . . . 0.0 110.851 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 15.2 m -59.95 -46.22 90.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.124 -174.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.859 ' HB3' ' HD3' ' A' 1001 ' ' LYS . . . -74.59 -31.97 62.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.689 0.28 . . . . 0.0 111.681 -173.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.648 ' HB1' ' HE3' ' A' 1001 ' ' LYS . . . -75.47 -37.54 60.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.956 0.408 . . . . 0.0 110.451 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 26.5 t60 -70.38 -30.3 67.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.278 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.42 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -68.95 -34.76 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.376 176.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.816 HD13 HD21 ' A' ' 998' ' ' LEU . 0.6 OUTLIER -63.95 -42.47 97.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 122.145 0.974 . . . . 0.0 109.715 173.118 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.9 -33.56 64.75 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.349 176.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.42 ' HB ' ' O ' ' A' 1027 ' ' ALA . 82.6 t -66.63 -33.77 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 172.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.737 ' HB2' HD22 ' A' ' 991' ' ' LEU . 1.9 p30 -72.36 -38.78 68.45 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.477 ' HB2' HD21 ' A' ' 932' ' ' LEU . . . -61.15 -44.72 96.87 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.692 171.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.654 ' O ' ' HG ' ' A' 1036 ' ' LEU . 60.0 tttm -63.76 -42.13 97.88 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.792 -176.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.586 ' O ' HG22 ' A' 1038 ' ' VAL . 66.1 t30 -73.2 -40.01 65.09 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.375 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.772 ' O ' HG12 ' A' 1039 ' ' ILE . 18.1 tp -73.76 -31.65 63.43 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.597 -177.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.781 ' HA ' HG12 ' A' ' 929' ' ' VAL . 4.3 pp -62.29 -37.02 83.92 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.464 ' N ' HD13 ' A' 1036 ' ' LEU . 29.2 t70 -75.67 -37.92 59.18 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.386 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.902 HG12 ' HB3' ' A' ' 983' ' ' GLU . 4.8 t -53.59 -59.07 2.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.98 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.772 HD13 ' HB ' ' A' ' 929' ' ' VAL . 3.5 pt -85.83 -24.73 6.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.153 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.45 ' HB2' ' CD1' ' A' ' 926' ' ' TYR . 19.7 t70 -61.08 -39.27 89.3 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.475 162.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.714 ' O ' ' HG2' ' A' 1045 ' ' LYS . 35.7 mt-30 -68.21 -35.08 77.42 Favored 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.393 171.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.62 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.98 -49.49 71.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.122 0.487 . . . . 0.0 110.717 174.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.819 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -47.4 -41.46 20.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.624 172.216 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.532 ' N ' ' HD3' ' A' 1043 ' ' ARG . 26.3 tp -79.97 -32.44 39.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.278 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.799 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 31.6 mmtp -63.13 -42.18 99.46 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.325 0.583 . . . . 0.0 109.973 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 25.6 ttt -69.12 -33.65 73.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.81 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.573 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 31.6 mm -69.53 -41.86 80.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.934 173.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 70.5 m -54.38 -28.03 40.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.615 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.92 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 2.2 tpm_? . . . . . 0 N--CA 1.449 -0.495 0 CA-C-O 120.742 0.306 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.412 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 38.3 m -123.59 46.14 2.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.684 -174.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 44.9 55.95 5.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.881 0.872 . . . . 0.0 112.934 173.491 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.592 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 23.8 t0 -47.8 -175.05 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.717 0 O-C-N 125.399 1.687 . . . . 0.0 111.845 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.524 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.2 tmtm? -37.0 -21.02 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.12 0.968 . . . . 0.0 112.874 -179.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.843 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 6.9 m -59.69 -51.44 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 O-C-N 122.144 -0.348 . . . . 0.0 111.299 173.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.426 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 27.4 t80 -75.63 -31.89 60.03 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -173.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.76 -58.07 7.23 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.874 -1.512 . . . . 0.0 111.651 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -70.6 -30.43 67.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.123 -173.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.633 HG22 HD12 ' A' ' 965' ' ' LEU . 61.2 t -66.19 -41.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.973 -0.691 . . . . 0.0 109.884 175.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.68 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 67.3 m -60.19 -35.86 76.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 169.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -59.52 -33.96 79.1 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.519 174.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.694 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 5.3 tt -63.7 -45.9 87.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.659 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.8 t -57.09 -42.54 79.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.915 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.68 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -63.71 -40.85 97.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.418 178.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 961' ' ' ALA . . . -79.16 -26.55 42.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.959 -177.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.596 ' O ' ' HB3' ' A' ' 939' ' ' MET . 15.0 p -79.01 -14.53 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.697 0.761 . . . . 0.0 109.128 172.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 933' ' ' VAL . 24.4 mm -69.83 -31.43 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 167.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.551 ' HG3' ' HA ' ' A' ' 935' ' ' ALA . 36.2 mt-10 -61.27 -39.05 88.97 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.939 174.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.727 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 43.6 ttp -51.37 -47.06 62.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.334 172.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.6 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.9 t -71.9 -39.18 69.74 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.048 178.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.419 ' HA ' HE21 ' A' ' 944' ' ' GLN . 46.7 m -71.71 -50.88 26.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.159 0.504 . . . . 0.0 110.564 -169.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.616 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -82.98 -11.48 58.1 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.566 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.912 HG13 ' HE1' ' A' ' 954' ' ' MET . 0.0 OUTLIER -77.17 -45.79 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.212 0.46 . . . . 0.0 111.378 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.6 ' HG2' ' O ' ' A' ' 940' ' ' SER . 0.1 OUTLIER -59.05 -46.81 99.42 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -173.349 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.584 ' HD3' ' HG3' ' A' ' 944' ' ' GLN . 79.2 Cg_endo -87.96 16.08 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.438 1.425 . . . . 0.0 113.545 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.659 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -125.72 154.26 73.15 Favored Pre-proline 0 C--N 1.328 -0.364 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.39 175.27 10.91 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 123.157 2.571 . . . . 0.0 111.821 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.911 ' HB3' HE21 ' A' 1006 ' ' GLN . 88.7 Cg_exo -50.24 -35.39 43.22 Favored 'Trans proline' 0 C--O 1.248 0.998 0 C-N-CA 123.118 2.545 . . . . 0.0 113.121 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -55.18 -25.27 31.45 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.857 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.659 ' HB2' ' HB2' ' A' ' 946' ' ' ALA . 53.3 mm-40 -106.94 -3.16 20.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.729 ' O ' ' HG3' ' A' ' 954' ' ' MET . 9.7 m-30 -61.31 -47.31 86.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 173.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.926 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.58 -44.01 12.2 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.876 177.019 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.926 ' HD3' HG12 ' A' ' 952' ' ' VAL . 88.5 Cg_exo -55.02 -29.72 66.34 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.805 1.67 . . . . 0.0 115.239 171.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.912 ' HE1' HG13 ' A' ' 943' ' ' ILE . 0.0 OUTLIER -72.95 -30.69 64.05 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.968 0.889 . . . . 0.0 109.644 178.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.798 HG13 ' HA ' ' A' ' 999' ' ' ILE . 0.6 OUTLIER -71.37 -26.2 26.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.003 174.455 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 953' ' ' PRO . 8.6 mtmp? -58.15 -38.53 76.76 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.438 175.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.59 -45.98 77.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.711 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.481 ' CG2' ' HB2' ' A' ' 939' ' ' MET . 2.2 t -65.42 -32.77 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.002 0.43 . . . . 0.0 110.788 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.79 -41.67 97.46 Favored Glycine 0 C--O 1.228 -0.232 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.775 177.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 62.6 tp -68.91 -33.47 73.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.242 0.544 . . . . 0.0 109.653 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 935' ' ' ALA . . . -53.64 -57.07 12.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.766 177.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.939 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -74.68 -21.13 59.57 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.578 -179.497 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -53.84 13.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.831 0.348 . . . . 0.0 110.322 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 7.0 m -58.22 -27.81 64.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.907 0.861 . . . . 0.0 109.488 173.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.675 HD21 HD22 ' A' 1035 ' ' LEU . 17.4 tp -70.76 -37.27 73.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.889 178.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -51.01 -33.39 24.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.882 172.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.84 77.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.798 0.332 . . . . 0.0 110.413 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.757 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.6 m -58.35 -46.1 86.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.306 173.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.781 HG13 HD13 ' A' ' 984' ' ' ILE . 96.6 t -52.43 -30.25 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.968 175.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.4 t70 -70.98 -29.06 64.94 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.289 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.629 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.5 mm-40 -65.57 -57.04 9.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.53 1.157 . . . . 0.0 109.036 172.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.483 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 53.0 p -58.5 -22.98 56.86 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.0 -1.0 . . . . 0.0 113.065 174.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.652 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 43.0 tp -56.83 -54.24 56.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.556 -179.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.652 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 52.3 Cg_exo -57.91 -23.71 60.95 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 121.6 1.533 . . . . 0.0 111.648 168.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.54 HG12 ' HB ' ' A' ' 980' ' ' THR . 44.0 t -74.89 -16.22 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.815 175.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.543 ' HB2' HG22 ' A' ' 984' ' ' ILE . 1.0 OUTLIER -69.01 -48.08 28.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 118.973 -0.537 . . . . 0.0 111.641 176.688 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.531 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 39.9 Cg_exo -60.5 -26.51 82.96 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 121.156 1.237 . . . . 0.0 111.103 170.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . 0.629 ' HA ' ' OE1' ' A' 1049 ' ' GLN . . . -70.42 -66.6 0.58 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.803 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.793 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.0 m -165.46 -27.27 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -174.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.614 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 2.8 t -65.13 -12.81 54.97 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -172.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.542 ' CD2' ' HG3' ' A' ' 985' ' ' GLU . 3.7 t60 -45.8 -44.5 14.11 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 122.761 0.424 . . . . 0.0 111.621 -169.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -55.18 -53.53 54.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 1.08 ' HB3' HG12 ' A' 1038 ' ' VAL . 1.0 OUTLIER -75.2 -43.45 51.88 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.781 HD13 HG13 ' A' ' 969' ' ' VAL . 11.3 tp -62.64 -26.62 41.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.297 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.542 ' HG3' ' CD2' ' A' ' 981' ' ' HIS . 1.3 mm-40 -74.08 -38.32 63.93 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.366 171.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.734 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 12.1 ptp -66.19 -62.44 1.48 Allowed 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.175 -174.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.699 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.23 -36.61 39.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -173.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.656 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.5 OUTLIER -69.47 -43.14 73.81 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.56 -175.064 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -66.36 -27.66 68.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.511 0.672 . . . . 0.0 109.244 173.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.511 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.8 tp -72.01 -39.92 68.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.494 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.824 HD13 HD21 ' A' 1035 ' ' LEU . 29.1 mt -59.76 -61.14 2.84 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.588 178.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -47.17 -37.8 10.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.113 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 71.0 m -67.43 -57.57 6.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.661 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.58 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 3.7 m-20 -93.66 -15.99 24.75 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.939 ' HG ' HD23 ' A' ' 962' ' ' LEU . 2.5 tm? -61.22 -50.6 72.41 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.626 1.103 . . . . 0.0 108.338 163.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.762 ' O ' ' HB3' ' A' 1000 ' ' ASN . . . -52.9 -30.73 35.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.544 172.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.691 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.8 tp10 -64.32 -45.24 88.75 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.676 HD12 ' HE1' ' A' 1021 ' ' MET . 4.1 mm? -77.54 -50.39 12.69 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.51 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.798 ' HA ' HG13 ' A' ' 955' ' ' VAL . 15.6 tt -57.0 -21.03 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 121.696 0.76 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.762 ' HB3' ' O ' ' A' ' 996' ' ' ALA . 0.6 OUTLIER -109.44 -22.19 12.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.578 -173.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.691 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 9.0 tptm -84.48 -36.45 22.26 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 123.126 0.266 . . . . 0.0 111.029 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.728 ' HA ' ' HE3' ' A' 1002 ' ' MET . 0.3 OUTLIER -78.69 -36.07 44.13 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.854 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.2 ttpt -58.73 -37.59 76.5 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 167.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' 1000 ' ' ASN . 8.4 tt -68.85 -50.13 52.49 Favored 'General case' 0 C--O 1.214 -0.776 0 O-C-N 123.774 0.671 . . . . 0.0 110.295 -176.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.592 ' HA ' ' HB2' ' A' 1017 ' ' TYR . . . -55.55 -46.39 77.13 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.804 0.811 . . . . 0.0 109.959 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.911 HE21 ' HB3' ' A' ' 948' ' ' PRO . 0.9 OUTLIER -76.19 -13.54 60.18 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.777 -178.707 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.854 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -95.96 -40.42 9.29 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.412 0.625 . . . . 0.0 111.593 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 51.3 t80 . . . . . 0 C--N 1.315 -0.905 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.803 -176.436 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.542 ' NE2' ' HB2' ' A' 1005 ' ' ALA . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.104 0 CA-C-O 120.813 0.34 . . . . 0.0 110.521 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -59.17 -25.79 64.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.004 -172.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -54.52 -58.5 7.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.35 0.595 . . . . 0.0 109.847 173.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.592 ' HB2' ' HA ' ' A' 1005 ' ' ALA . 0.1 OUTLIER -55.0 -33.14 62.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.539 177.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 58.2 tttm -71.38 -45.47 62.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.904 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.62 -27.97 64.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.857 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.91 -44.08 94.49 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 170.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.676 ' HE1' HD12 ' A' ' 998' ' ' LEU . 1.7 tmt? -61.82 -42.08 98.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.581 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.91 -39.04 76.97 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.162 0.506 . . . . 0.0 110.784 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 31.4 m -69.57 -46.74 65.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.149 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.542 ' O ' HD23 ' A' ' 998' ' ' LEU . . . -60.67 -36.09 77.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.543 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.465 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -59.04 -35.8 73.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.086 0.47 . . . . 0.0 110.754 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG21 ' A' 1030 ' ' VAL . 16.2 t-160 -67.31 -31.7 72.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.78 177.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.49 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -72.35 -55.74 6.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.062 -178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.914 HD21 ' HA ' ' A' ' 995' ' ' LEU . 24.5 tp -58.74 -35.85 73.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.046 0.451 . . . . 0.0 111.531 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.41 -36.93 66.99 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.879 0.371 . . . . 0.0 111.548 170.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' 1026 ' ' HIS . 82.6 t -64.14 -36.18 76.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 175.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.58 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 11.0 m-20 -60.59 -44.56 96.11 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.982 0.42 . . . . 0.0 110.486 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.535 ' HB3' HD22 ' A' ' 932' ' ' LEU . . . -59.52 -54.0 51.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.514 174.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -53.37 -38.29 63.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.408 ' O ' HG22 ' A' 1038 ' ' VAL . 54.0 t30 -71.58 -54.02 11.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.186 -178.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.824 HD21 HD13 ' A' ' 991' ' ' LEU . 15.0 tp -57.52 -33.19 67.81 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.885 179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.569 ' N ' HG11 ' A' ' 929' ' ' VAL . 38.7 tp -52.62 -47.29 67.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.857 0.837 . . . . 0.0 109.842 176.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.3 t70 -68.51 -42.15 78.94 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.355 174.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 1.08 HG12 ' HB3' ' A' ' 983' ' ' GLU . 17.0 t -52.97 -61.91 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.459 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.781 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.864 HD13 ' H ' ' A' 1040 ' ' ASP . 1.4 pp -82.45 -30.2 9.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.864 ' H ' HD13 ' A' 1039 ' ' ILE . 44.1 t0 -56.88 -37.49 71.45 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 165.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.669 ' O ' ' HG2' ' A' 1045 ' ' LYS . 2.7 mp0 -73.15 -36.56 66.68 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 114.536 -1.211 . . . . 0.0 109.63 172.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.666 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.49 -52.44 59.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.24 0.543 . . . . 0.0 111.232 176.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.92 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 0.3 OUTLIER -58.83 -31.0 68.08 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.94 179.198 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 920' ' ' ARG . 11.1 mp -77.88 -31.85 51.59 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.943 -0.117 . . . . 0.0 111.22 171.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.793 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 32.9 mmtp -59.87 -36.93 77.94 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.812 0.815 . . . . 0.0 108.915 175.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 42.2 ttp -69.22 -36.81 77.61 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.473 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' 1043 ' ' ARG . 48.6 mm -64.69 -42.45 95.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.539 172.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 37.3 m -55.98 -46.61 78.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.841 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1049 ' ' GLN . . . . . 0.629 ' OE1' ' HA ' ' A' ' 978' ' ' ALA . 24.9 tt0 . . . . . 0 N--CA 1.461 0.118 0 CA-C-O 120.575 0.226 . . . . 0.0 111.581 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.983 ' HG3' ' HB2' ' A' 1043 ' ' ARG . 3.4 mmp_? . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 32.4 t 63.19 16.52 9.46 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -166.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 923' ' ' ASP . 1.3 m120 55.65 72.33 0.49 Allowed 'General case' 0 CA--C 1.498 -1.047 0 CA-C-N 114.326 -1.307 . . . . 0.0 109.602 -174.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.549 ' C ' ' H ' ' A' ' 925' ' ' VAL . 4.8 t70 -46.63 -174.75 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.532 0 O-C-N 126.299 2.249 . . . . 0.0 113.074 -168.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.59 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 3.1 tmtm? -46.9 -8.05 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.731 0.812 . . . . 0.0 112.307 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.703 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 0.0 OUTLIER -72.26 -49.76 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 C-N-CA 122.704 0.402 . . . . 0.0 110.896 174.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 14.9 t80 -73.3 -25.81 60.81 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.111 0.958 . . . . 0.0 108.416 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' A' ' 930' ' ' THR . 97.1 mt-10 -73.54 -57.4 4.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.333 -177.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -66.49 -32.79 74.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.491 -171.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.966 HG12 ' HA ' ' A' 1036 ' ' LEU . 12.2 p -67.38 -40.97 85.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.789 177.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 934' ' ' LYS . 59.6 m -53.8 -31.99 51.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.821 0.343 . . . . 0.0 110.694 166.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 934' ' ' LYS . . . -66.99 -31.97 79.52 Favored Glycine 0 C--O 1.227 -0.307 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 176.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 1.127 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 18.9 tp -61.57 -51.06 70.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 173.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.5 t -60.87 -31.37 49.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.275 0.56 . . . . 0.0 110.906 174.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.559 ' HD2' HG22 ' A' ' 930' ' ' THR . 0.0 OUTLIER -72.13 -43.53 64.55 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.008 -178.572 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 1.007 ' HB1' ' HB3' ' A' ' 961' ' ' ALA . . . -75.83 -25.26 56.11 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 122.201 -0.312 . . . . 0.0 111.349 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.562 ' HA ' HG11 ' A' ' 958' ' ' VAL . 7.5 p -75.87 -13.05 14.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 119.636 -0.825 . . . . 0.0 109.644 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.667 HG12 ' O ' ' A' ' 933' ' ' VAL . 37.4 mm -71.11 -31.04 43.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 168.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 12.2 mm-40 -57.88 -40.71 80.88 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 171.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.457 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 47.6 ttp -56.47 -45.22 81.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.572 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.477 ' O ' HG23 ' A' ' 943' ' ' ILE . 16.2 p -73.19 -31.54 64.27 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.593 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 8.0 p -78.5 -40.8 34.23 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -177.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 4.4 mmtp -52.37 -47.16 66.34 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.47 174.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.602 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 16.5 tt -70.67 -22.35 23.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.522 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.812 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 32.9 mm-40 -55.68 -61.98 5.33 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.579 178.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.812 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 12.2 Cg_endo -92.92 -31.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.833 1.689 . . . . 0.0 114.086 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.545 ' HB2' ' HG3' ' A' ' 950' ' ' GLU . . . -83.82 150.41 58.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.218 0.532 . . . . 0.0 112.371 -169.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.618 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 72.6 Cg_endo -83.87 -177.83 3.28 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.371 2.714 . . . . 0.0 113.156 -177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 4.8 Cg_endo -49.3 -36.57 38.14 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 124.245 3.297 . . . . 0.0 113.96 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -55.06 -20.17 8.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.664 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.642 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 61.4 mm-40 -107.71 -4.96 17.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.615 ' HA ' ' HE1' ' A' ' 954' ' ' MET . 14.9 m-30 -57.61 -42.19 82.75 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.003 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.49 -46.87 3.3 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 119.181 -1.007 . . . . 0.0 112.531 177.347 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.003 ' HD3' HG12 ' A' ' 952' ' ' VAL . 78.2 Cg_exo -57.49 -29.45 84.78 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.562 1.508 . . . . 0.0 114.676 171.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.615 ' HE1' ' HA ' ' A' ' 951' ' ' TYR . 19.6 ptp -73.81 -31.88 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.446 0.641 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.72 HG11 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -72.29 -25.6 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.325 174.111 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 17.9 tppt? -58.57 -41.68 86.22 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.443 ' H ' ' HG2' ' A' ' 957' ' ' GLU . 3.9 mm-40 -52.99 -45.82 68.01 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.884 175.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.667 HG21 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -66.69 -29.71 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.022 178.119 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.517 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -67.4 -41.69 90.57 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.91 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.72 -40.6 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 109.901 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 1.127 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -48.45 -57.48 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 173.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.733 ' HB2' HD11 ' A' ' 995' ' ' LEU . 5.2 tt -70.52 -28.9 65.3 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 119.162 -1.015 . . . . 0.0 111.651 177.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -56.8 -57.24 13.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.701 0.286 . . . . 0.0 110.746 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 1.7 p -58.57 -44.55 89.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.18 0.514 . . . . 0.0 110.365 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 57.1 tp -51.1 -41.58 60.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.133 175.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 73.8 mt -54.82 -36.52 65.07 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.93 93.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.972 0.415 . . . . 0.0 109.978 175.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.673 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -63.85 -38.94 92.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.016 173.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 82.0 t -54.79 -31.9 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 O-C-N 122.235 -0.291 . . . . 0.0 110.802 172.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 2.7 m-20 -73.03 -22.48 60.63 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.757 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.547 ' O ' HG22 ' A' ' 975' ' ' VAL . 19.5 mm-40 -74.23 -44.35 53.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.176 0.988 . . . . 0.0 108.638 171.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.488 ' OG ' HG21 ' A' ' 980' ' ' THR . 32.8 t -69.2 -24.13 63.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.892 177.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.711 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 55.7 tp -59.91 -50.68 85.33 Favored Pre-proline 0 C--O 1.218 -0.58 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.505 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.481 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 11.5 Cg_endo -61.12 -26.17 82.22 Favored 'Trans proline' 0 C--N 1.355 0.908 0 CA-C-N 121.424 1.544 . . . . 0.0 110.927 170.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.547 HG22 ' O ' ' A' ' 971' ' ' GLU . 2.9 t -77.15 -11.08 13.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.222 174.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.765 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 1.9 tt -69.16 -53.23 14.07 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.62 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.455 ' N ' HD22 ' A' ' 976' ' ' LEU . 45.0 Cg_endo -69.44 -19.46 37.61 Favored 'Trans proline' 0 C--N 1.358 1.048 0 CA-C-N 120.457 1.199 . . . . 0.0 110.933 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -67.97 -55.31 13.2 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.694 172.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.672 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 31.1 m -166.11 -35.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -175.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.807 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.4 m -64.17 -18.43 64.47 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -168.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.765 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 11.6 t-160 -48.81 -26.43 2.39 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -172.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -72.2 -56.1 6.12 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.383 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.763 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.11 -42.65 62.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.626 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.807 ' HB ' HG22 ' A' ' 980' ' ' THR . 12.0 tt -58.76 -30.94 43.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.195 -174.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -72.68 -37.73 67.8 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.285 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.602 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 13.6 ptp -67.23 -59.06 3.74 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.629 -176.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.867 ' HB1' HG21 ' A' 1038 ' ' VAL . . . -68.41 -45.57 72.28 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 1.136 ' HA ' HD11 ' A' ' 991' ' ' LEU . 6.1 tt0 -58.23 -44.32 88.19 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.616 -175.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -61.6 -33.88 74.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.424 0.63 . . . . 0.0 109.933 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.65 -42.55 61.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.469 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.136 HD11 ' HA ' ' A' ' 988' ' ' GLN . 14.5 mt -53.43 -58.13 8.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 174.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -45.65 -48.15 14.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.184 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.422 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 4.5 p -73.06 -47.62 43.07 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.011 -176.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.465 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.1 m-20 -82.09 -38.67 24.51 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -170.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.793 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.9 OUTLIER -56.26 -60.21 3.83 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.623 0.647 . . . . 0.0 109.798 170.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.45 -23.46 38.96 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.899 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 993' ' ' SER . 20.5 tt0 -70.56 -43.24 69.89 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.297 -0.961 . . . . 0.0 108.554 177.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.554 ' HA ' ' HB1' ' A' 1024 ' ' ALA . 0.3 OUTLIER -60.84 -47.54 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.624 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.7 mt -55.63 -68.55 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.381 -179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.818 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -54.05 -18.91 4.06 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 114.395 -1.275 . . . . 0.0 113.108 177.897 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.612 ' HG3' ' HB2' ' A' 1024 ' ' ALA . 24.6 mmtp -85.26 -37.69 19.74 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.873 0.761 . . . . 0.0 111.395 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.483 ' HE3' ' SD ' ' A' ' 954' ' ' MET . 57.2 mtp -79.18 -34.78 42.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.651 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.9 tttm -63.54 -40.94 98.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 113.568 -1.651 . . . . 0.0 108.699 170.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.818 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.3 tp -60.77 -46.82 88.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.041 173.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.454 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -58.97 -45.18 91.18 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.6 0.714 . . . . 0.0 109.989 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -77.12 -6.58 53.42 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.261 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.651 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp-100 -91.09 -22.46 20.71 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.319 175.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 64.6 t80 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.48 -176.777 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.818 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.713 0.292 . . . . 0.0 110.698 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.501 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 9.5 tt0 -53.59 -36.08 61.56 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.37 -59.3 4.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.116 0.484 . . . . 0.0 111.44 175.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.676 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.1 m-30 -62.27 -35.74 79.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.858 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.818 ' HB2' HE22 ' A' 1014 ' ' GLN . 86.2 tttt -55.63 -39.35 70.7 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.575 172.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 26.5 tptp -68.29 -44.19 76.01 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -57.73 -33.08 68.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.96 174.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.732 ' HG2' ' O ' ' A' 1018 ' ' LYS . 9.0 ptt? -75.34 -25.66 57.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' 1018 ' ' LYS . 94.1 mt -71.15 -38.07 72.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.009 0.433 . . . . 0.0 109.857 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 98.9 m -59.76 -41.39 90.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.994 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.612 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -64.79 -38.39 90.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.159 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -62.6 -38.62 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.457 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.53 ' O ' HG23 ' A' 1030 ' ' VAL . 4.6 t-160 -68.78 -39.38 80.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.47 174.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.465 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -63.77 -51.64 63.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.782 -177.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.793 HD11 ' HA ' ' A' ' 995' ' ' LEU . 0.2 OUTLIER -60.79 -43.87 97.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.868 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.535 ' N ' HD21 ' A' 1028 ' ' LEU . . . -53.6 -28.3 31.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.819 173.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' 1026 ' ' HIS . 88.5 t -72.4 -45.71 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 121.221 -0.192 . . . . 0.0 110.736 174.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.752 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.3 p30 -64.49 -47.27 79.58 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.632 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' 1036 ' ' LEU . . . -52.96 -29.08 26.82 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.457 ' O ' HD12 ' A' 1036 ' ' LEU . 35.7 ttpt -83.49 -48.77 9.94 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.451 0.644 . . . . 0.0 109.308 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.534 ' O ' HG23 ' A' 1038 ' ' VAL . 2.2 t30 -61.54 -47.97 83.13 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.349 -176.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.869 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 12.6 tp -67.75 -33.22 74.42 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.798 -177.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.966 ' HA ' HG12 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -58.28 -27.43 64.03 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.543 0.687 . . . . 0.0 109.66 177.535 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.596 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.0 t0 -92.09 -34.49 14.35 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.636 -1.165 . . . . 0.0 108.694 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.869 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 21.7 t -63.62 -53.32 46.42 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 CA-C-N 115.423 -0.808 . . . . 0.0 113.108 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.777 HD12 ' HB ' ' A' ' 929' ' ' VAL . 4.1 pt -82.01 -30.49 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 122.432 -0.168 . . . . 0.0 111.228 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.895 ' O ' ' HD3' ' A' 1043 ' ' ARG . 19.9 t0 -53.78 -29.78 41.75 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 118.532 -1.267 . . . . 0.0 110.662 157.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.596 ' HG3' ' O ' ' A' 1037 ' ' ASP . 58.9 mt-30 -81.46 -28.73 34.01 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 120.372 -1.455 . . . . 0.0 109.742 169.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.626 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -55.18 -52.94 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.823 0.344 . . . . 0.0 110.843 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.983 ' HB2' ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -62.34 -33.14 74.12 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 177.118 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.503 ' O ' ' HB ' ' A' 1047 ' ' ILE . 3.7 tp -79.08 -22.4 45.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.53 -0.731 . . . . 0.0 110.493 175.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.672 ' HG3' ' HB3' ' A' ' 979' ' ' SER . 13.7 mptt -62.75 -37.0 84.86 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 166.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.42 ' HB3' ' O ' ' A' 1043 ' ' ARG . 22.9 ttt -67.96 -36.11 79.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.373 174.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.503 ' HB ' ' O ' ' A' 1044 ' ' LEU . 27.9 mm -60.65 -43.98 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.91 172.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.578 ' HB3' ' O ' ' A' 1045 ' ' LYS . 35.9 t -47.75 -38.06 14.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.492 174.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 . . . . . 0 C--N 1.328 -0.33 0 CA-C-O 120.629 0.252 . . . . 0.0 111.295 178.609 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.932 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 7.4 tpt180 . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 8.1 p -80.45 39.22 0.45 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -176.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.685 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.4 OUTLIER 47.93 56.81 6.73 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.047 0.939 . . . . 0.0 112.339 172.869 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 925' ' ' VAL . 5.0 p-10 -47.24 -171.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 O-C-N 125.946 2.029 . . . . 0.0 113.632 -175.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.595 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.3 tmtp? -42.04 -8.54 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.568 1.147 . . . . 0.0 113.403 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 1.031 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 2.7 m -73.4 -53.81 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 O-C-N 122.078 -0.389 . . . . 0.0 110.9 174.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.519 ' HD1' ' HB2' ' A' 1040 ' ' ASP . 62.3 t80 -76.69 -28.81 56.05 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.055 0.931 . . . . 0.0 108.829 -172.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.404 ' O ' ' HB ' ' A' ' 930' ' ' THR . 5.3 mm-40 -74.91 -52.27 11.67 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.522 -177.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.595 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 58.1 t30 -73.35 -31.04 63.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -173.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.993 HG12 HD12 ' A' 1039 ' ' ILE . 11.5 p -65.03 -42.22 94.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.596 175.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.669 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 73.6 m -52.0 -30.48 25.38 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-O 120.718 0.294 . . . . 0.0 110.495 166.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -60.83 -31.61 76.47 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.196 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.835 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 1.3 tt -66.92 -41.76 86.53 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.635 ' O ' HG12 ' A' ' 937' ' ' ILE . 40.1 t -63.89 -32.99 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.203 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -73.84 -31.18 63.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.37 0.605 . . . . 0.0 109.434 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.566 ' CB ' ' HB3' ' A' ' 961' ' ' ALA . . . -77.98 -30.39 50.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.141 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.515 HG13 ' HA ' ' A' ' 933' ' ' VAL . 11.5 p -79.15 -12.73 13.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 175.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.635 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -70.1 -38.73 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 165.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.535 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 43.5 mt-10 -61.26 -44.86 96.56 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.416 172.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.571 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 25.2 ttt -56.88 -45.56 82.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.703 176.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 13.7 t -66.45 -34.03 77.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.61 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.647 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 47.6 m -76.46 -28.59 56.59 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.081 0.943 . . . . 0.0 109.245 -177.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.546 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 20.4 mmtm -69.7 -62.31 1.43 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.222 176.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.807 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -59.62 -31.78 47.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.401 -167.689 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.699 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 50.6 mt-30 -73.89 -64.24 0.78 Allowed Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.337 -175.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.8 Cg_endo -90.29 14.73 2.01 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.151 1.234 . . . . 0.0 114.675 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 942' ' ' LYS . . . -127.51 153.61 77.43 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 121.875 -0.516 . . . . 0.0 111.164 175.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.499 ' HB2' ' OE1' ' A' ' 949' ' ' GLU . 4.2 Cg_exo -81.02 176.22 9.12 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.637 2.891 . . . . 0.0 112.629 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.668 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 81.6 Cg_exo -50.97 -32.26 37.6 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.755 2.97 . . . . 0.0 114.792 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.499 ' OE1' ' HB2' ' A' ' 947' ' ' PRO . 1.8 pm0 -55.65 -32.17 62.98 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.904 175.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.61 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER -91.97 -1.91 57.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 176.549 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.727 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.6 m-30 -65.83 -32.89 74.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.993 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -76.17 -51.61 2.67 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 119.129 -1.028 . . . . 0.0 112.046 173.204 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.944 ' HD3' HG13 ' A' ' 952' ' ' VAL . 81.1 Cg_exo -52.99 -30.3 48.17 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.167 1.911 . . . . 0.0 114.897 170.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.807 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.2 ptt? -65.25 -42.29 93.46 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.633 0.73 . . . . 0.0 109.739 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.567 ' HB ' ' HB3' ' A' 1002 ' ' MET . 79.0 t -73.62 -26.3 21.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.913 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.546 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.6 OUTLIER -53.32 -45.75 69.15 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.872 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.8 mm-40 -55.13 -48.59 73.45 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.981 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.464 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 4.1 m -74.01 -28.34 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.45 ' HA2' HD23 ' A' ' 995' ' ' LEU . . . -72.49 -43.53 44.56 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.646 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.45 HD21 ' HD3' ' A' ' 956' ' ' LYS . 4.3 mm? -62.33 -38.74 90.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.185 -0.508 . . . . 0.0 109.674 172.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.835 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -50.18 -55.85 13.46 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 171.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.481 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 2.4 tm? -66.43 -34.86 78.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.111 0.414 . . . . 0.0 110.621 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -56.84 -53.35 58.91 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 122.109 -0.369 . . . . 0.0 111.254 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.403 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 26.3 m -64.35 -40.15 95.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.301 0.572 . . . . 0.0 110.126 177.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.481 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 23.5 tp -53.11 -39.69 63.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.562 172.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.81 -27.7 63.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -65.11 -42.49 93.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 171.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.615 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.3 m -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.729 171.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.817 HG13 HD12 ' A' ' 984' ' ' ILE . 90.4 t -54.49 -30.62 21.89 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.446 174.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.611 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 29.5 t70 -75.89 -26.87 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.512 0.196 . . . . 0.0 111.161 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 975' ' ' VAL . 19.4 mm-40 -70.77 -48.65 53.21 Favored 'General case' 0 C--O 1.247 0.921 0 CA-C-O 122.707 1.242 . . . . 0.0 107.943 173.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.531 ' OG ' HG21 ' A' ' 980' ' ' THR . 35.3 t -69.58 -22.98 63.48 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 114.361 -1.291 . . . . 0.0 110.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 1.081 ' HA ' HD13 ' A' ' 976' ' ' LEU . 1.7 tm? -54.43 -55.29 38.98 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.593 -177.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.611 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.3 Cg_endo -58.05 -26.8 77.01 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 120.749 1.303 . . . . 0.0 110.682 170.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.0 -16.28 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.62 175.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 1.081 HD13 ' HA ' ' A' ' 973' ' ' LEU . 10.8 mp -58.87 -61.37 7.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-O 118.983 -0.532 . . . . 0.0 110.553 173.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 50.5 Cg_exo -57.05 -31.31 89.82 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 121.68 1.587 . . . . 0.0 111.539 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . 0.402 ' HB3' ' HB2' ' A' 1049 ' ' GLN . . . -61.02 -54.78 40.7 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.77 174.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.775 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -171.11 -37.8 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -176.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.655 HG22 ' HB ' ' A' ' 984' ' ' ILE . 25.2 m -59.27 -22.09 60.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -170.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 976' ' ' LEU . 0.9 OUTLIER -52.66 -20.48 3.12 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -173.085 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -70.51 -55.94 7.75 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.738 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 1.037 ' HB3' HG11 ' A' 1038 ' ' VAL . 0.7 OUTLIER -75.23 -42.87 54.37 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.985 HD11 HD11 ' A' ' 976' ' ' LEU . 18.6 tt -60.85 -36.4 71.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 119.025 -1.07 . . . . 0.0 109.047 -173.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -59.42 -40.63 87.32 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.969 -0.693 . . . . 0.0 111.488 171.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.607 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 8.1 ptp -68.07 -63.25 1.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.588 -177.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.12 -33.47 50.48 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.404 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 24.4 tm0? -71.51 -41.43 69.24 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.383 0.992 . . . . 0.0 110.0 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -71.14 -23.03 62.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.589 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.3 tp -70.11 -48.79 56.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.092 175.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 79.7 mt -53.6 -43.29 68.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.013 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -50.57 -39.13 48.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.539 173.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 35.8 t -77.34 -50.32 13.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.43 ' CG ' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p30 -72.59 -39.66 67.18 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -174.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.45 HD23 ' HA2' ' A' ' 959' ' ' GLY . 2.0 tm? -56.88 -48.15 78.84 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 171.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.766 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -52.12 -26.48 11.35 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 171.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.671 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 5.2 mm-40 -79.08 -34.91 43.21 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.525 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.877 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 10.3 mp -80.22 -32.09 38.51 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.857 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.766 HG12 ' HA ' ' A' ' 996' ' ' ALA . 44.3 pt -68.94 -20.42 24.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.779 175.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.671 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 1.6 p30 -95.99 -17.37 21.05 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.877 ' HB3' ' HA ' ' A' ' 998' ' ' LEU . 37.2 tptt -65.86 -40.77 91.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.152 0.501 . . . . 0.0 109.906 168.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.993 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.0 ptt? -78.29 -34.42 48.82 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.866 ' O ' ' HB2' ' A' 1007 ' ' GLN . 27.1 tttp -61.42 -56.81 16.1 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.044 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.463 ' HA ' HD22 ' A' 1004 ' ' LEU . 14.0 mt -66.4 -48.32 70.48 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.884 -172.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.77 -47.91 84.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.41 0.624 . . . . 0.0 110.481 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.44 59.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.528 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.866 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.9 tp-100 -80.78 -43.14 20.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.3 0.571 . . . . 0.0 110.062 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.639 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 14.5 m-85 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.375 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.732 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.529 ' N ' HE21 ' A' 1015 ' ' GLN . 0.0 OUTLIER -53.78 -34.71 59.94 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.138 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.478 ' HG3' ' N ' ' A' 1017 ' ' TYR . 0.4 OUTLIER -49.49 -59.56 3.64 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.52 1.152 . . . . 0.0 110.236 171.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HD2' ' A' 1008 ' ' TYR . 86.8 m-85 -69.04 -29.95 68.21 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.031 -1.895 . . . . 0.0 110.928 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.732 ' HB2' HE22 ' A' 1014 ' ' GLN . 81.4 tttt -58.15 -46.91 84.86 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.253 165.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -76.72 -59.59 2.71 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.046 0.451 . . . . 0.0 112.058 -172.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -57.81 -46.31 84.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.19 -176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.863 ' HA ' ' HE3' ' A' 1021 ' ' MET . 20.4 mmt -74.73 -17.66 60.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.344 -177.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' 1018 ' ' LYS . 34.6 tp -70.92 -30.87 67.32 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 22.4 m -65.39 -38.66 90.67 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.664 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.351 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.734 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -63.9 -34.84 78.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.869 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.452 ' O ' HG21 ' A' 1030 ' ' VAL . 40.2 t-80 -68.47 -31.32 70.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.719 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.49 43.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.659 HD23 HD23 ' A' ' 998' ' ' LEU . 0.3 OUTLIER -56.21 -48.35 76.6 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.049 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.52 ' N ' HD21 ' A' 1028 ' ' LEU . . . -54.2 -33.11 57.44 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.459 ' O ' ' HB3' ' A' 1033 ' ' LYS . 85.1 t -84.13 -38.61 14.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.994 0.426 . . . . 0.0 111.027 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.544 ' OD1' HD23 ' A' ' 990' ' ' LEU . 66.2 m-20 -72.7 -29.32 63.28 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.983 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.492 ' HB2' HD11 ' A' ' 932' ' ' LEU . . . -52.62 -55.2 24.07 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 161.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.645 ' O ' ' HB3' ' A' 1036 ' ' LEU . 5.0 tmmm? -52.31 -29.45 23.45 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 172.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.452 ' O ' HG22 ' A' 1038 ' ' VAL . 60.5 t30 -68.13 -48.32 65.72 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.41 -0.806 . . . . 0.0 109.193 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.818 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 10.3 tp -64.18 -32.49 74.08 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.88 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.928 ' HA ' HG12 ' A' ' 929' ' ' VAL . 3.0 tm? -48.65 -32.15 7.82 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.88 0.872 . . . . 0.0 109.781 173.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.597 ' O ' ' HG3' ' A' 1041 ' ' GLN . 22.3 t70 -92.74 -35.96 13.17 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.821 178.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 1.037 HG11 ' HB3' ' A' ' 983' ' ' GLU . 38.1 t -55.92 -62.21 0.9 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.215 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 1.031 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -75.94 -33.33 25.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.923 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.953 ' H ' HD13 ' A' 1039 ' ' ILE . 26.5 t70 -54.76 -31.37 58.55 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.47 162.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.8 ' HB3' ' HE2' ' A' 1045 ' ' LYS . 50.5 mt-30 -77.5 -33.76 54.32 Favored 'General case' 0 C--O 1.206 -1.232 0 C-N-CA 118.964 -1.094 . . . . 0.0 108.25 171.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.639 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.86 -53.07 60.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.571 0.544 . . . . 0.0 110.679 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.932 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.76 -42.79 17.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.404 172.072 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.492 ' N ' ' HD3' ' A' 1043 ' ' ARG . 60.3 tp -79.4 -28.94 41.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.644 0.259 . . . . 0.0 111.398 177.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.8 ' HE2' ' HB3' ' A' 1041 ' ' GLN . 73.0 mmtt -60.31 -43.85 95.97 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.859 0.838 . . . . 0.0 109.267 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 18.8 ttt -62.99 -36.33 83.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.347 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.874 HD13 ' HB2' ' A' ' 920' ' ' ARG . 39.3 mm -62.15 -49.96 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.509 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 39.1 t -52.35 -40.05 61.48 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.631 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1049 ' ' GLN . . . . . 0.402 ' HB2' ' HB3' ' A' ' 978' ' ' ALA . 48.7 tp60 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.558 ' HB2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.421 0.629 . . . . 0.0 111.373 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 16.8 p -112.25 19.35 17.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.097 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.45 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.44 53.97 11.98 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.505 -174.227 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.597 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 29.8 t70 -47.33 -175.31 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 O-C-N 125.834 1.959 . . . . 0.0 112.268 -173.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.498 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.6 tmtp? -35.51 -24.09 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 124.294 1.038 . . . . 0.0 112.024 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.813 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.1 m -59.23 -52.41 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.297 175.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -76.96 -21.27 55.01 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 122.122 0.963 . . . . 0.0 108.975 -177.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -79.31 -54.59 5.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.087 -174.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HE2' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.63 -32.54 68.08 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.812 -177.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.993 HG12 ' HA ' ' A' 1036 ' ' LEU . 9.8 p -63.71 -38.34 82.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.476 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.538 ' CG2' HD11 ' A' 1036 ' ' LEU . 7.7 p -70.17 -28.3 65.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.4 -30.59 65.01 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.335 171.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.968 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 4.2 tt -68.08 -48.73 64.74 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.588 ' O ' HG12 ' A' ' 937' ' ' ILE . 36.0 t -57.51 -44.63 85.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 110.343 174.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 0.0 OUTLIER -59.04 -32.18 69.52 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.043 176.598 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.618 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.7 -26.63 40.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.583 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.624 ' O ' ' HB3' ' A' ' 939' ' ' MET . 14.7 p -83.49 -12.56 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.035 171.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 933' ' ' VAL . 46.0 mm -73.83 -39.07 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 164.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.618 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.6 mm-40 -52.57 -33.8 47.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.314 169.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.956 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 32.5 ttm -60.03 -45.82 91.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.974 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.565 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 48.8 m -68.25 -30.05 69.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.173 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.671 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.6 m -76.49 -33.8 58.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.824 0.821 . . . . 0.0 109.008 -177.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.606 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 19.5 mmtt -60.09 -50.47 73.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.195 -1.366 . . . . 0.0 112.28 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . . . . . . . . . 6.8 tp -69.67 -23.69 26.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.049 -176.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.712 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.9 mt-30 -52.68 -61.73 4.28 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.712 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 73.6 Cg_endo -99.62 10.0 0.72 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.783 1.656 . . . . 0.0 115.148 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 950' ' ' GLU . . . -139.24 159.67 65.34 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 118.885 0.766 . . . . 0.0 112.844 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.702 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 1.5 Cg_endo -83.5 173.92 9.25 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.859 3.039 . . . . 0.0 111.569 174.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 91.4 Cg_exo -48.4 -16.29 0.66 Allowed 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 124.264 3.309 . . . . 0.0 115.277 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -54.43 -18.5 4.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.21 169.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.702 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.0 OUTLIER -95.4 -15.42 23.04 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.655 175.189 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.5 ' HB2' ' O ' ' A' ' 948' ' ' PRO . 5.8 m-30 -49.38 -44.14 44.69 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.566 0.698 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.09 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.1 OUTLIER -69.84 -56.66 7.31 Favored Pre-proline 0 CA--C 1.555 1.169 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.134 177.617 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.946 ' HD3' HG11 ' A' ' 952' ' ' VAL . 83.5 Cg_exo -55.71 -35.08 92.61 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.509 2.139 . . . . 0.0 114.964 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.956 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 24.6 ptt? -65.41 -42.18 92.83 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.798 -0.563 . . . . 0.0 110.091 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.648 ' CG2' ' HB3' ' A' 1002 ' ' MET . 74.7 t -67.41 -28.6 42.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.996 170.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.5 tmpt? -60.29 -40.15 89.44 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 33.5 mm-40 -54.37 -45.97 72.93 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.423 174.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.592 ' O ' ' HB2' ' A' ' 961' ' ' ALA . 1.8 t -75.73 -29.6 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.19 -44.09 77.5 Favored Glycine 0 N--CA 1.455 -0.09 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.829 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.446 HD23 ' HE3' ' A' ' 956' ' ' LYS . 11.0 mp -64.52 -21.29 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 110.574 171.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.968 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -63.2 -53.05 59.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.565 177.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.663 ' HB3' HD23 ' A' ' 995' ' ' LEU . 2.7 tm? -72.51 -28.8 63.1 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.121 177.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -54.69 -59.59 4.51 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.756 -0.59 . . . . 0.0 111.717 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 17.2 p -55.87 -37.73 69.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.235 0.54 . . . . 0.0 110.559 175.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.733 HD22 HD22 ' A' 1035 ' ' LEU . 23.8 tp -65.85 -27.88 68.56 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.994 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 49.3 tp -64.71 -34.45 78.34 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.65 90.71 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.576 0.703 . . . . 0.0 109.714 173.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.813 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 4.1 m -66.97 -39.68 87.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.04 173.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.641 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 70.8 t -54.62 -37.24 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.497 174.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 35.0 t70 -71.8 -22.77 61.52 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.528 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 20.3 mm-40 -65.74 -52.93 47.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 123.187 1.47 . . . . 0.0 108.06 168.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.552 ' OG ' HG23 ' A' ' 980' ' ' THR . 42.3 t -66.06 -25.43 67.03 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.291 -1.777 . . . . 0.0 111.855 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.649 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 53.7 mt -61.35 -51.01 80.88 Favored Pre-proline 0 C--O 1.214 -0.798 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.921 -177.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.566 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 57.2 Cg_exo -56.64 -30.05 82.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 121.567 1.595 . . . . 0.0 111.075 168.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' 1042 ' ' ALA . 3.2 t -75.6 -13.36 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.827 176.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.649 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.9 tt -64.35 -55.47 30.36 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.566 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 51.9 Cg_exo -56.72 -32.26 90.52 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.61 1.54 . . . . 0.0 111.37 174.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.18 -65.05 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.012 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.761 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.1 m -157.99 -36.76 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.78 HG21 ' HB ' ' A' ' 984' ' ' ILE . 4.9 m -55.43 -18.48 7.04 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -174.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.639 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 16.1 p-80 -48.78 -20.19 0.45 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 79.7 mtt180 -78.11 -55.39 5.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.077 0.942 . . . . 0.0 110.154 175.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.861 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.71 -45.77 23.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.389 -175.023 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.78 ' HB ' HG21 ' A' ' 980' ' ' THR . 8.7 tp -56.78 -34.05 42.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.469 -172.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 0.0 OUTLIER -74.45 -34.5 63.19 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.165 179.279 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.66 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.0 ptp -60.75 -56.4 21.69 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 119.958 -0.697 . . . . 0.0 112.294 -174.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.573 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.62 -33.71 41.23 Favored 'General case' 0 C--O 1.209 -1.042 0 O-C-N 122.262 -0.274 . . . . 0.0 110.973 -176.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 1.077 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.6 tt0 -61.12 -46.09 92.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.099 0.475 . . . . 0.0 110.889 -176.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.6 -31.48 72.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.71 175.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.682 ' HG ' ' OD1' ' A' 1031 ' ' ASP . 5.7 tp -75.19 -32.9 61.35 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.653 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.077 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.2 mt -63.58 -48.44 77.39 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.199 0.523 . . . . 0.0 110.053 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -58.06 -38.27 75.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.451 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 4.6 t -60.75 -49.86 75.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.059 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.02 -27.82 10.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.678 -0.809 . . . . 0.0 113.103 -165.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.812 HD12 HD21 ' A' 1028 ' ' LEU . 5.7 tp -56.86 -48.03 79.06 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 167.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -58.09 -46.66 85.12 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.513 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' 1001 ' ' LYS . 10.3 mm-40 -62.81 -36.65 83.87 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.241 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.646 ' HG ' HG13 ' A' ' 955' ' ' VAL . 47.0 tp -66.82 -33.4 75.53 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 995' ' ' LEU . 75.9 mt -61.53 -35.97 70.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.897 175.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.656 ' O ' ' HB2' ' A' 1004 ' ' LEU . 49.1 m-80 -89.22 -6.61 56.73 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.526 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 67.1 mmtt -86.58 -36.33 18.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 174.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.09 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -70.87 -38.12 73.09 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.458 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.802 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.0 tttm -60.37 -54.24 47.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.224 -1.353 . . . . 0.0 108.889 172.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.736 ' HG ' ' CD2' ' A' 1017 ' ' TYR . 14.9 tp -57.89 -48.22 80.49 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.53 90.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.336 0.589 . . . . 0.0 110.426 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -76.34 -12.12 60.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.565 0.697 . . . . 0.0 109.8 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.802 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -81.67 -28.08 33.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.07 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 56.6 t80 . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.63 -179.127 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.448 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 110.682 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.716 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.8 tt0 -56.13 -31.03 62.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.556 -171.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -51.35 -57.34 9.17 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.214 0.531 . . . . 0.0 110.531 171.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.736 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.0 m-30 -73.81 -23.52 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.703 178.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.716 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 62.2 tttp -64.43 -44.65 90.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.24 178.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' 1015 ' ' GLN . 97.3 mttt -59.53 -56.58 20.22 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.987 0.422 . . . . 0.0 109.946 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -50.89 -40.33 56.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.531 174.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.66 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 19.6 ttt -62.43 -52.21 64.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.4 tp -61.93 -35.24 77.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 40.1 m -63.76 -34.34 77.68 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.156 0.503 . . . . 0.0 110.811 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.658 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -79.7 -39.07 32.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.337 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -59.75 -43.85 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.144 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.46 ' O ' HG23 ' A' 1030 ' ' VAL . 56.6 t60 -59.48 -36.24 75.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.379 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.4 65.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 995' ' ' LEU . 5.0 tp -73.11 -32.0 64.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 178.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.95 -49.87 75.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.17 173.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' 1026 ' ' HIS . 99.2 t -69.17 -19.95 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 121.664 0.745 . . . . 0.0 110.622 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.791 ' OD2' ' HA ' ' A' ' 991' ' ' LEU . 0.6 OUTLIER -76.65 -43.79 36.67 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.031 177.25 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.613 ' HB2' HD21 ' A' ' 932' ' ' LEU . . . -57.13 -42.15 80.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -63.93 -33.94 76.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.975 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.641 ' O ' HG22 ' A' 1038 ' ' VAL . 65.6 t30 -67.38 -43.69 80.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.858 HD21 HD11 ' A' ' 991' ' ' LEU . 16.3 tp -75.7 -24.39 56.24 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.993 ' HA ' HG12 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -63.2 -32.67 74.12 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 120.876 0.369 . . . . 0.0 110.427 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.575 ' N ' HD22 ' A' 1036 ' ' LEU . 32.2 t70 -86.7 -36.9 18.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.861 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 25.4 t -52.82 -63.15 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.354 176.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.878 HD13 ' HB ' ' A' ' 929' ' ' VAL . 4.4 pt -81.54 -28.63 10.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.188 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -51.7 -48.41 63.55 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 163.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.696 ' O ' ' HG2' ' A' 1045 ' ' LYS . 41.8 mt-30 -71.75 -25.94 62.25 Favored 'General case' 0 C--O 1.203 -1.35 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.224 177.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.699 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -52.7 -54.68 30.18 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 118.177 0.444 . . . . 0.0 110.969 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.597 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 2.0 mpt_? -55.35 -32.96 62.98 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.138 174.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.502 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 55.2 tp -72.61 -37.05 68.21 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.874 174.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.761 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 68.5 mmtt -58.88 -33.44 70.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.454 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 27.1 ttt -73.07 -37.16 66.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.576 -178.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' 1043 ' ' ARG . 51.4 mm -61.16 -45.77 97.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.2 t -56.47 -60.25 3.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.243 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 55.3 tp60 . . . . . 0 C--N 1.327 -0.41 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -174.796 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.557 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 36.0 m -86.91 26.45 1.14 Allowed 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.997 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.557 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.6 62.17 2.3 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.11 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.621 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 6.5 t0 -46.01 -176.17 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 125.733 1.895 . . . . 0.0 112.702 -173.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.511 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.8 tmtp? -36.59 -24.82 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 124.236 1.014 . . . . 0.0 111.914 177.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.833 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.1 m -58.63 -52.3 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.104 175.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.428 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 64.1 t80 -75.92 -24.66 55.56 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -176.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 31.1 mt-10 -70.51 -55.9 7.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.544 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.521 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 0.2 OUTLIER -73.77 -32.89 64.01 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.468 -176.586 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.93 HG12 ' HA ' ' A' 1036 ' ' LEU . 5.5 p -62.84 -35.83 72.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.294 176.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.66 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 6.5 p -72.43 -32.71 66.54 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.79 -31.28 67.47 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.35 172.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.617 ' O ' HG11 ' A' ' 936' ' ' VAL . 2.8 tp -62.0 -46.79 87.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 173.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.528 ' O ' HG23 ' A' ' 936' ' ' VAL . 61.3 t -62.8 -37.78 80.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.907 0.384 . . . . 0.0 110.442 174.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.4 mmpt? -62.47 -31.97 72.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.388 0.613 . . . . 0.0 109.784 176.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.687 ' HB2' ' HB2' ' A' ' 961' ' ' ALA . . . -81.61 -24.6 36.31 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.561 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.734 ' O ' ' HG2' ' A' ' 939' ' ' MET . 1.6 m -79.61 -10.76 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 C-N-CA 119.211 -0.996 . . . . 0.0 109.358 172.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.525 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 67.0 mt -73.86 -30.54 28.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 167.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.571 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 7.5 mm-40 -55.21 -47.42 75.32 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.001 170.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.734 ' HG2' ' O ' ' A' ' 936' ' ' VAL . 11.5 ptt? -62.19 -40.6 96.6 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.283 0.364 . . . . 0.0 110.604 -175.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.692 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.5 p -68.9 -31.55 70.54 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.568 0.223 . . . . 0.0 111.27 -178.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.686 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.8 m -80.08 -42.75 23.05 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.5 tppp? -59.67 -39.34 84.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 113.268 -1.787 . . . . 0.0 111.479 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.775 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -73.64 -31.98 33.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 121.321 -0.152 . . . . 0.0 110.975 -179.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.1 mt-30 -49.91 -61.84 3.2 Favored Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.686 ' HD3' ' O ' ' A' ' 941' ' ' SER . 93.7 Cg_endo -99.12 16.1 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.09 1.86 . . . . 0.0 113.42 -172.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.934 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -116.39 151.84 47.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.455 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 5.4 Cg_exo -80.91 -179.63 5.26 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.766 2.978 . . . . 0.0 110.516 170.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.545 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 10.2 Cg_endo -53.41 -24.88 29.45 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.804 2.336 . . . . 0.0 113.063 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.461 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 36.3 mt-10 -57.17 -44.11 83.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.718 178.113 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.934 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 1.9 mp0 -94.03 1.09 56.27 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.569 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.601 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.6 m-85 -58.12 -45.56 87.07 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 170.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.067 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -72.33 -47.01 10.54 Favored Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 119.502 -0.879 . . . . 0.0 112.293 176.127 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.067 ' HD3' HG13 ' A' ' 952' ' ' VAL . 80.4 Cg_exo -51.47 -30.78 36.41 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 122.093 1.862 . . . . 0.0 115.108 171.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.775 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 2.4 ptt? -64.62 -46.02 84.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.95 -1.1 . . . . 0.0 108.653 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.665 ' N ' ' HG3' ' A' ' 954' ' ' MET . 0.3 OUTLIER -64.33 -25.06 37.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.777 173.827 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.495 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.4 ttmm -61.85 -37.59 85.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 176.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -59.35 -46.73 87.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.863 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 955' ' ' VAL . 9.0 m -65.5 -28.16 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.605 176.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.82 64.47 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.179 -1.01 . . . . 0.0 111.921 178.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.38 -36.63 71.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.95 0.405 . . . . 0.0 110.24 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.687 ' HB2' ' HB2' ' A' ' 935' ' ' ALA . . . -56.9 -56.04 26.73 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.792 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.524 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 30.6 tp -63.08 -35.5 80.47 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.649 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.48 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 52.1 mtm-85 -62.73 -48.95 77.02 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.272 176.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.496 HG21 ' OD1' ' A' ' 928' ' ' ASN . 5.5 m -56.08 -39.05 71.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.773 0.797 . . . . 0.0 109.792 172.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.547 HD22 HD21 ' A' ' 932' ' ' LEU . 64.8 tp -62.48 -27.66 69.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.974 176.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 86.1 mt -64.77 -28.94 69.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.331 178.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.84 -40.93 97.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.249 0.547 . . . . 0.0 109.713 172.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.757 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.5 m -61.46 -43.74 98.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.57 172.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.523 HG12 HD11 ' A' ' 984' ' ' ILE . 91.2 t -54.88 -31.42 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.157 177.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 14.9 t70 -75.78 -26.3 57.21 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.573 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 57.1 mm-40 -70.66 -49.15 50.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 122.709 1.242 . . . . 0.0 108.92 171.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.618 ' OG ' HG22 ' A' ' 980' ' ' THR . 43.3 t -68.28 -24.69 64.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.67 -1.604 . . . . 0.0 111.649 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.706 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 3.8 tt -61.43 -51.45 77.38 Favored Pre-proline 0 C--O 1.218 -0.591 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.614 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.61 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.4 Cg_exo -59.82 -27.35 84.73 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 121.09 1.425 . . . . 0.0 111.214 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.553 HG21 ' O ' ' A' ' 971' ' ' GLU . 2.7 t -78.24 -11.8 13.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.318 175.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.85 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.8 tt -65.64 -54.86 26.98 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.207 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.539 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 28.3 Cg_endo -64.84 -23.53 62.28 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.302 1.334 . . . . 0.0 111.186 174.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.94 -60.38 3.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.375 172.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.789 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.3 m -165.35 -34.43 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -177.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.821 HG23 ' HB ' ' A' ' 984' ' ' ILE . 22.0 m -55.83 -19.91 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -172.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.85 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 11.7 p-80 -49.74 -21.15 0.99 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.891 0.701 . . . . 0.0 112.891 -173.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -73.98 -52.96 11.14 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.672 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 1.018 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.75 -43.38 30.99 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.202 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.821 ' HB ' HG23 ' A' ' 980' ' ' THR . 0.0 OUTLIER -58.27 -34.75 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -173.316 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -73.81 -32.4 63.72 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.657 175.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.783 ' HE2' ' HG3' ' A' ' 983' ' ' GLU . 12.0 ptt? -69.14 -54.44 14.89 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.564 -175.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.67 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.08 -33.92 38.45 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.985 ' HA ' HD12 ' A' ' 991' ' ' LEU . 53.3 tp60 -59.37 -46.42 88.69 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.258 0.481 . . . . 0.0 111.049 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -67.76 -25.69 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.505 0.669 . . . . 0.0 109.965 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 1.7 tp -73.25 -42.33 62.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.305 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.985 HD12 ' HA ' ' A' ' 988' ' ' GLN . 10.3 mt -58.57 -49.15 78.48 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 121.365 0.602 . . . . 0.0 109.897 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.424 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 10.2 t30 -55.73 -41.08 73.35 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.545 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.6 t -69.48 -43.09 73.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.61 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.418 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 35.7 m-20 -95.63 -41.0 9.12 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.195 -0.602 . . . . 0.0 112.383 -169.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.017 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.38 -53.13 61.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 175.317 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 992' ' ' ASN . . . -60.6 -48.58 81.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.439 -177.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.0 pt-20 -64.34 -32.02 73.45 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 118.949 -1.1 . . . . 0.0 111.414 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.716 HD22 HD11 ' A' 1028 ' ' LEU . 54.9 tp -64.48 -38.27 90.43 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.852 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.544 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 76.8 mt -55.59 -39.22 53.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.401 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.683 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 33.8 m-80 -95.49 -5.27 43.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.004 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 15.8 tptp -83.35 -44.39 14.91 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.903 ' HE3' ' HG3' ' A' 1021 ' ' MET . 40.0 tpp -78.51 -31.14 47.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.947 173.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.769 ' O ' ' HB2' ' A' 1007 ' ' GLN . 83.3 tttt -58.34 -49.21 77.99 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 171.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1004 ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.33 -37.29 82.73 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.405 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -67.63 -44.8 77.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.381 0.61 . . . . 0.0 110.69 178.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -74.26 -9.72 58.89 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.229 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.769 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.7 OUTLIER -91.53 -10.5 40.48 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.124 -0.943 . . . . 0.0 109.718 175.646 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 26.1 t80 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.271 -177.308 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.589 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.053 0.454 . . . . 0.0 109.884 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.524 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 46.5 mt-30 -67.42 -30.68 70.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.779 -175.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.58 -47.44 57.95 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.675 169.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.405 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.6 m-30 -77.42 -24.71 50.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.776 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.589 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 83.9 tttt -72.44 -37.21 68.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.754 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -66.77 -50.81 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -46.86 -40.99 14.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.271 170.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.903 ' HG3' ' HE3' ' A' 1002 ' ' MET . 14.3 tmm? -61.46 -43.15 99.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.443 177.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.6 -42.0 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.755 0.312 . . . . 0.0 111.089 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 12.5 m -63.36 -36.4 83.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.064 0.459 . . . . 0.0 110.551 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.25 -36.23 47.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.814 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.628 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -65.1 -31.87 73.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.628 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.548 ' O ' HG23 ' A' 1030 ' ' VAL . 61.4 t60 -72.1 -46.38 56.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.109 176.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.79 85.97 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.088 0.471 . . . . 0.0 109.981 177.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 1.017 HD13 ' HA ' ' A' ' 995' ' ' LEU . 2.0 tt -58.74 -51.77 68.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.557 172.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.82 65.38 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.712 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' 1026 ' ' HIS . 84.5 t -66.4 -33.81 65.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 174.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.655 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.1 p30 -71.89 -41.92 67.39 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -55.81 -50.37 70.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 0.0 110.025 171.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' 1036 ' ' LEU . 13.3 tptm -66.5 -37.17 84.49 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.921 -1.036 . . . . 0.0 112.005 -174.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.566 ' O ' HG22 ' A' 1038 ' ' VAL . 60.4 t30 -75.71 -35.11 60.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.412 -174.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 7.0 tp -77.67 -30.04 51.8 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.93 ' HA ' HG12 ' A' ' 929' ' ' VAL . 6.4 tt -48.77 -41.67 33.16 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.698 0.761 . . . . 0.0 109.538 172.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -75.71 -46.74 29.47 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.205 174.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 1.018 HG12 ' HB3' ' A' ' 983' ' ' GLU . 17.7 t -48.02 -58.91 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.833 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.6 pp -83.44 -30.46 8.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.798 ' H ' HD12 ' A' 1039 ' ' ILE . 5.5 t0 -56.94 -42.48 80.14 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 165.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.706 ' O ' ' HG2' ' A' 1045 ' ' LYS . 55.0 mt-30 -75.12 -23.62 57.93 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-N 114.332 -1.304 . . . . 0.0 110.837 174.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.693 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -54.38 -55.36 29.4 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 118.818 0.735 . . . . 0.0 110.721 171.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.621 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 0.9 OUTLIER -58.66 -27.67 64.98 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.703 173.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.558 HD21 ' O ' ' A' 1044 ' ' LEU . 5.8 tt -75.35 -32.87 61.0 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.018 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.795 ' HG3' ' HA ' ' A' ' 980' ' ' THR . 74.1 mmtt -61.39 -30.28 70.45 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 175.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 24.5 ttt -77.23 -30.26 54.48 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.931 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.456 ' HB ' ' O ' ' A' 1044 ' ' LEU . 48.5 mm -65.36 -46.55 90.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 169.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 52.4 m -55.67 -37.54 68.43 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.972 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 48.4 tt0 . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.341 175.932 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 1.024 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 21.1 t -97.78 25.55 5.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.175 0.512 . . . . 0.0 109.728 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.11 62.33 2.72 Favored 'General case' 0 CA--C 1.498 -1.045 0 CA-C-O 122.129 0.966 . . . . 0.0 109.479 -176.399 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.514 ' HB2' ' HG3' ' A' 1043 ' ' ARG . 29.4 m-20 -44.62 -171.6 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 110.77 -2.923 . . . . 0.0 113.547 -176.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.491 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 1.2 tmtm? -38.09 -17.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.883 0.873 . . . . 0.0 112.865 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.98 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 15.8 m -65.05 -52.97 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 O-C-N 122.155 -0.341 . . . . 0.0 111.719 177.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.492 ' N ' HG23 ' A' ' 925' ' ' VAL . 46.4 t80 -75.89 -22.3 56.27 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -174.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -74.52 -61.64 1.8 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.209 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.43 ' OD1' HG21 ' A' ' 964' ' ' THR . 0.2 OUTLIER -65.96 -31.79 72.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.806 -173.972 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.738 HG11 ' HA ' ' A' 1036 ' ' LEU . 11.0 p -65.25 -43.42 95.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.605 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 18.4 p -71.21 -25.17 62.4 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.77 -27.95 62.39 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.028 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.905 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 4.8 tt -65.56 -46.43 79.52 Favored 'General case' 0 CA--C 1.523 -0.065 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 172.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.613 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.1 t -58.71 -41.71 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.644 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.605 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.7 OUTLIER -65.49 -27.69 68.67 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.061 0.457 . . . . 0.0 110.972 177.596 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.55 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -81.28 -26.17 35.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.198 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.568 ' HA ' HG11 ' A' ' 958' ' ' VAL . 13.3 p -82.96 -12.49 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.638 0.733 . . . . 0.0 109.489 172.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.613 HG12 ' O ' ' A' ' 933' ' ' VAL . 49.4 mm -66.95 -34.6 71.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.55 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.8 mt-10 -62.18 -47.53 84.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.063 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.59 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.8 ttp -55.57 -39.74 71.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.19 176.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 13.3 t -61.93 -38.2 87.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.07 0.462 . . . . 0.0 110.546 178.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.0 m -78.24 -40.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.165 0.983 . . . . 0.0 108.597 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.723 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 5.9 tmtp? -67.86 -34.94 77.66 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.278 -177.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.516 ' O ' HD11 ' A' ' 943' ' ' ILE . 0.0 OUTLIER -73.4 -28.4 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.281 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.662 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 74.5 mt-30 -49.7 -54.24 33.59 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.624 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.662 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.6 Cg_endo -99.63 21.43 0.26 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.94 1.76 . . . . 0.0 113.37 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -94.95 130.11 33.79 Favored Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -171.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 92.9 Cg_endo -85.31 -179.31 3.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.034 2.489 . . . . 0.0 108.94 158.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.748 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 73.5 Cg_exo -51.07 -33.7 44.21 Favored 'Trans proline' 0 C--O 1.241 0.647 0 C-N-CA 122.048 1.832 . . . . 0.0 112.089 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.529 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 5.0 mp0 -55.07 -42.24 72.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.244 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.648 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 29.7 mm-40 -94.86 -5.8 44.19 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.468 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.748 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 12.1 m-30 -59.82 -37.32 78.84 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.906 HG11 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -73.3 -53.47 4.71 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 120.282 -0.567 . . . . 0.0 112.054 176.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.906 ' HD3' HG11 ' A' ' 952' ' ' VAL . 63.6 Cg_exo -56.65 -31.57 87.78 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.033 1.822 . . . . 0.0 114.454 175.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.59 ' HG3' ' HG3' ' A' ' 939' ' ' MET . 18.4 ptt? -68.42 -36.71 79.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.232 1.015 . . . . 0.0 109.592 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.953 HG12 ' HA ' ' A' ' 999' ' ' ILE . 84.3 t -71.87 -25.41 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.868 174.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.552 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 59.4 tttp -56.24 -39.51 72.67 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.75 -48.17 75.73 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.032 175.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 936' ' ' VAL . 3.8 m -76.52 -22.82 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-O 120.944 0.402 . . . . 0.0 112.017 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.55 -42.17 64.11 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.675 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.25 -24.57 63.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.91 0.386 . . . . 0.0 110.004 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.905 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -57.0 -56.39 22.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.62 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.588 HD12 HD13 ' A' ' 991' ' ' LEU . 53.7 tp -72.4 -31.5 65.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.199 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.46 ' C ' ' HD3' ' A' ' 963' ' ' ARG . 3.3 tmt_? -61.54 -53.67 53.34 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.43 HG21 ' OD1' ' A' ' 928' ' ' ASN . 15.7 m -59.14 -32.34 69.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.301 0.572 . . . . 0.0 110.526 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.814 HD13 HD11 ' A' ' 932' ' ' LEU . 0.5 OUTLIER -63.79 -41.67 97.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.937 177.254 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 96.6 mt -53.04 -31.22 40.22 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.317 174.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -49.61 74.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.415 0.626 . . . . 0.0 109.795 173.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.83 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -56.2 -46.23 79.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.629 170.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.451 HG13 HD12 ' A' ' 984' ' ' ILE . 90.4 t -53.36 -30.81 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.81 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 13.0 t70 -70.6 -33.1 70.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.325 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.576 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.8 mm-40 -60.49 -54.59 43.73 Favored 'General case' 0 C--O 1.247 0.946 0 CA-C-O 122.603 1.192 . . . . 0.0 108.46 171.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 40.0 t -55.61 -26.82 46.12 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 114.224 -1.353 . . . . 0.0 112.129 174.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 1.039 ' HA ' HD13 ' A' ' 976' ' ' LEU . 7.0 tt -57.99 -53.85 61.57 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-O 118.7 -0.666 . . . . 0.0 111.743 -174.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.621 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.8 Cg_exo -54.87 -26.99 51.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 CA-C-N 120.857 1.342 . . . . 0.0 111.25 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.716 HG11 ' HB2' ' A' 1046 ' ' MET . 3.8 t -78.3 -17.32 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 120.073 -0.651 . . . . 0.0 111.554 176.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 1.039 HD13 ' HA ' ' A' ' 973' ' ' LEU . 8.6 mp -56.86 -64.37 2.59 Favored Pre-proline 0 N--CA 1.471 0.616 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.36 173.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.698 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 15.2 Cg_endo -57.67 -30.33 88.5 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.625 1.55 . . . . 0.0 111.826 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -58.17 -57.39 13.08 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.355 174.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 1.072 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 59.9 m -163.3 -47.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.118 0.485 . . . . 0.0 111.463 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.715 HG23 ' HB ' ' A' ' 984' ' ' ILE . 23.8 m -48.54 -24.12 1.21 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.539 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 49.8 p-80 -50.06 -32.51 15.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -66.71 -52.86 39.65 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 119.455 1.025 . . . . 0.0 111.968 176.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.763 ' HB3' HG11 ' A' 1038 ' ' VAL . 0.2 OUTLIER -70.71 -45.54 64.76 Favored 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.338 -179.23 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 1.033 HG22 ' HG ' ' A' ' 976' ' ' LEU . 8.8 tp -57.68 -39.38 69.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.609 -175.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 11.7 pt-20 -69.98 -27.28 64.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.014 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.584 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 5.4 ptp -71.97 -46.74 56.26 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.801 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.921 ' HB3' HG22 ' A' 1038 ' ' VAL . . . -72.48 -47.09 51.52 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.847 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.883 ' HA ' HD12 ' A' ' 991' ' ' LEU . 27.2 tt0 -57.59 -45.69 84.95 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -175.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -65.22 -35.08 79.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.441 0.639 . . . . 0.0 109.315 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.77 -35.6 78.99 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.682 177.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.883 HD12 ' HA ' ' A' ' 988' ' ' GLN . 15.6 mt -61.3 -57.47 12.2 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.316 0.579 . . . . 0.0 109.671 175.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -45.8 -43.0 12.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.053 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 17.1 p -76.26 -46.55 27.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.515 ' HB2' ' HB3' ' A' 1031 ' ' ASP . 1.0 OUTLIER -82.65 -37.32 25.05 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -169.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.656 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.9 OUTLIER -58.61 -47.0 85.83 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 168.443 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.825 ' HA ' HG21 ' A' ' 999' ' ' ILE . . . -52.7 -28.38 21.66 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -77.13 -34.08 56.67 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 118.575 -1.25 . . . . 0.0 108.693 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.671 HD23 HD12 ' A' 1028 ' ' LEU . 18.6 tp -78.23 -29.03 48.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.953 ' HA ' HG12 ' A' ' 955' ' ' VAL . 5.8 tt -77.21 -0.74 3.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-O 121.908 0.861 . . . . 0.0 108.827 172.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.684 ' HA ' ' HB2' ' A' 1003 ' ' LYS . 6.8 m-80 -102.78 -6.36 22.67 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.62 170.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 1.014 ' HD3' ' HB2' ' A' 1021 ' ' MET . 42.3 tptt -73.12 -36.8 66.78 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 162.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.73 ' HB2' ' HB ' ' A' ' 955' ' ' VAL . 24.2 ttm -64.77 -60.96 2.49 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.42 -1.264 . . . . 0.0 108.626 171.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.777 ' O ' ' HB2' ' A' 1007 ' ' GLN . 45.3 mttp -65.17 -57.11 9.38 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.241 -174.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.663 HD23 ' HB3' ' A' 1017 ' ' TYR . 8.4 tt -82.3 -31.31 30.06 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -163.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.518 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -71.33 -43.19 67.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.075 178.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.431 HE21 ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -76.79 -26.28 54.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.458 176.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.777 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.9 tp-100 -53.83 -52.96 58.68 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.828 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.634 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 28.1 m-85 . . . . . 0 C--N 1.321 -0.639 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.851 -175.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.726 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.88 -22.41 62.31 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -53.99 -59.54 4.5 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 167.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.726 ' CD2' ' HA ' ' A' 1014 ' ' GLN . 0.3 OUTLIER -61.55 -20.43 63.25 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.713 ' O ' ' HB3' ' A' 1021 ' ' MET . 39.5 ttmt -79.35 -43.46 23.48 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.301 171.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.4 ' HE2' ' HB3' ' A' 1019 ' ' LYS . 5.8 tmmm? -68.04 -41.88 81.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.397 0.618 . . . . 0.0 109.343 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -56.23 -31.46 63.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.696 173.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1021 ' ' MET . . . . . 1.014 ' HB2' ' HD3' ' A' 1001 ' ' LYS . 43.5 ttp -56.49 -44.73 80.93 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 173.369 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.69 -43.05 76.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.595 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.1 m -71.38 -46.57 59.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.714 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.94 76.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.713 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -64.26 -36.35 83.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 110.491 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' 1030 ' ' VAL . 14.1 t-80 -66.94 -42.25 85.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.16 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.53 -47.54 85.09 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.477 0.485 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.693 ' HA ' ' OD2' ' A' 1031 ' ' ASP . 0.9 OUTLIER -65.41 -42.26 92.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.588 0.709 . . . . 0.0 110.233 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.61 -28.95 61.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.907 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' 1026 ' ' HIS . 74.2 t -74.29 -47.69 39.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.122 177.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.693 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -59.74 -42.36 92.99 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.694 179.193 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -62.83 -49.95 72.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.982 0.42 . . . . 0.0 110.436 175.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.727 ' HA ' HD23 ' A' 1036 ' ' LEU . 87.6 tttt -59.81 -38.51 82.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.706 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.526 ' O ' HG21 ' A' 1038 ' ' VAL . 9.1 t30 -72.4 -53.72 11.43 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.315 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.807 HD22 HD11 ' A' ' 991' ' ' LEU . 29.0 tp -56.5 -33.96 66.5 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.141 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.738 ' HA ' HG11 ' A' ' 929' ' ' VAL . 1.8 pp -61.79 -38.67 88.92 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.809 0.731 . . . . 0.0 109.396 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 12.0 t70 -66.97 -40.07 87.36 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.181 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.921 HG22 ' HB3' ' A' ' 987' ' ' ALA . 76.7 t -60.87 -68.44 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.653 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.98 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -70.07 -33.75 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -173.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.815 ' H ' HD11 ' A' 1039 ' ' ILE . 6.9 t70 -48.81 -45.18 40.04 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 122.43 1.109 . . . . 0.0 108.372 166.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.616 ' O ' ' HG2' ' A' 1045 ' ' LYS . 82.1 mm-40 -79.11 -24.84 43.13 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 113.487 -1.688 . . . . 0.0 111.134 177.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.658 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.01 -55.02 31.15 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.526 173.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 1.024 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 21.8 mmm180 -57.86 -32.97 68.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.829 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.619 HD13 ' HB ' ' A' 1047 ' ' ILE . 60.3 tp -77.99 -26.33 48.55 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 121.113 -0.235 . . . . 0.0 111.235 175.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 1.072 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 46.7 mmtm -57.08 -44.45 83.11 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.664 0.745 . . . . 0.0 109.536 171.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.716 ' HB2' HG11 ' A' ' 975' ' ' VAL . 26.9 ttt -65.62 -38.93 90.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.66 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.619 ' HB ' HD13 ' A' 1044 ' ' LEU . 49.7 mm -66.87 -35.81 75.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.894 175.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 36.9 t -60.55 -53.85 52.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.91 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 C--N 1.328 -0.356 0 CA-C-O 121.046 0.451 . . . . 0.0 110.911 -178.363 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.915 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 20.3 tpt180 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.472 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 67.5 m 71.27 105.37 0.06 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -160.32 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.661 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -53.53 85.44 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -166.884 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 922' ' ' ASN . 1.9 t70 -47.16 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 112.785 -2.007 . . . . 0.0 113.238 -174.307 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.471 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.9 tmtp? -41.82 -23.15 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.428 -178.534 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.782 ' HA ' HG22 ' A' ' 968' ' ' THR . 1.9 m -56.41 -54.86 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 118.745 -0.645 . . . . 0.0 112.048 172.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.661 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 20.2 t80 -74.37 -34.91 63.5 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 118.843 -1.143 . . . . 0.0 107.934 -175.133 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 11.8 mm-40 -58.68 -57.27 13.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.113 -1.858 . . . . 0.0 112.877 -176.47 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.447 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 3.1 t-20 -73.72 -35.26 65.08 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.905 -171.554 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.754 HG23 ' CD2' ' A' ' 965' ' ' LEU . 3.8 t -61.69 -36.03 71.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.036 -0.666 . . . . 0.0 110.235 175.012 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.565 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 42.5 m -66.5 -37.75 85.74 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 171.942 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.36 -30.37 64.58 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.691 174.3 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.529 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 18.9 tp -61.42 -39.38 90.56 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 173.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.613 ' O ' HG13 ' A' ' 937' ' ' ILE . 48.0 t -66.14 -40.73 87.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.607 173.256 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.565 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.5 OUTLIER -61.73 -33.69 74.49 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 178.438 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.674 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -80.63 -26.56 37.65 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.33 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.569 ' O ' ' HG2' ' A' ' 939' ' ' MET . 9.5 p -78.19 -16.44 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 119.448 -0.901 . . . . 0.0 108.877 171.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 933' ' ' VAL . 51.4 mt -67.33 -38.13 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 167.112 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.674 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 64.9 mm-40 -52.52 -38.52 59.84 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.123 172.221 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.914 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.9 ptt? -61.63 -40.57 95.34 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 t -74.24 -31.05 62.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.378 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.651 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.1 t -71.57 -52.55 17.57 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.538 0.685 . . . . 0.0 110.095 -176.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.516 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -80.18 -11.03 59.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.03 -173.602 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.959 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -79.65 -26.97 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.748 0.785 . . . . 0.0 109.264 173.772 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.8 mt-30 -60.97 -51.77 76.98 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.83 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.651 ' HD3' ' O ' ' A' ' 941' ' ' SER . 85.5 Cg_endo -97.3 17.57 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.459 1.439 . . . . 0.0 114.992 -176.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -130.65 167.47 21.07 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.406 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 6.5 Cg_endo -90.52 170.02 3.81 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 124.031 3.154 . . . . 0.0 111.776 168.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.647 ' C ' ' H ' ' A' ' 950' ' ' GLU . 5.4 Cg_endo -47.06 -26.68 5.31 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 124.908 3.739 . . . . 0.0 115.023 -167.028 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 8.7 mm-40 -52.5 0.7 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.921 170.349 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.959 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -106.9 -25.17 11.77 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 109.74 -0.466 . . . . 0.0 109.74 179.31 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.482 ' HA ' ' HE3' ' A' ' 954' ' ' MET . 21.6 m-85 -47.02 -42.34 18.07 Favored 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 173.27 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.079 HG12 ' HD3' ' A' ' 953' ' ' PRO 0.25 0.4 OUTLIER -73.89 -58.29 2.17 Favored Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 119.028 -1.069 . . . . 0.0 113.024 178.52 . . . . . . . . 4 4 . 1 . 021 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.079 ' HD3' HG12 ' A' ' 952' ' ' VAL . 36.0 Cg_exo -64.4 -18.52 63.37 Favored 'Trans proline' 0 C--N 1.358 1.075 0 C-N-CA 121.92 1.747 . . . . 0.0 114.631 178.011 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.914 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 22.7 ptt? -70.8 -43.09 69.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 176.797 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.773 ' HB ' ' HB3' ' A' 1002 ' ' MET . 78.9 t -68.54 -27.64 37.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.664 172.329 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.686 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.4 tptm -52.32 -45.08 65.45 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 171.818 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 954' ' ' MET . 4.7 mm-40 -56.34 -46.77 79.78 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.988 177.648 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.526 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 9.8 p -81.93 -22.18 9.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -178.546 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.54 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -70.46 -45.34 54.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.842 -1.17 . . . . 0.0 112.016 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.413 HD23 ' HD3' ' A' ' 963' ' ' ARG . 87.5 mt -65.92 -24.35 66.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.686 0.279 . . . . 0.0 110.443 170.642 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.529 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -61.8 -55.41 30.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.665 175.865 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.894 HD12 ' HB2' ' A' ' 995' ' ' LEU . 6.7 tt -66.4 -27.45 67.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.501 -0.479 . . . . 0.0 110.656 179.609 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.413 ' HD3' HD23 ' A' ' 960' ' ' LEU . 17.1 mtp180 -65.69 -48.07 73.27 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.961 -0.462 . . . . 0.0 111.287 171.037 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 22.1 m -55.99 -40.52 73.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.739 0.781 . . . . 0.0 109.68 171.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.754 ' CD2' HG23 ' A' ' 929' ' ' VAL . 1.3 tm? -59.32 -28.69 67.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.482 175.151 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.28 -25.08 64.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.993 178.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 971' ' ' GLU . . . -68.74 -36.96 79.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.101 171.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.782 HG22 ' HA ' ' A' ' 925' ' ' VAL . 2.1 m -64.44 -40.8 96.43 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.379 172.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 984' ' ' ILE . 85.4 t -55.35 -32.36 29.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.2 172.091 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.489 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.6 t70 -80.06 -29.53 39.22 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.806 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.642 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.6 mm-40 -64.13 -50.22 69.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.617 1.198 . . . . 0.0 108.828 170.527 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.59 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.0 t -64.55 -23.11 67.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.306 176.312 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.653 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 60.1 tp -57.02 -52.93 70.4 Favored Pre-proline 0 C--O 1.218 -0.558 0 CA-C-O 118.713 -0.661 . . . . 0.0 112.431 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.642 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.4 Cg_exo -58.14 -27.99 82.17 Favored 'Trans proline' 0 C--N 1.357 1.024 0 CA-C-N 121.202 1.465 . . . . 0.0 111.044 169.364 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.47 HG11 ' HB2' ' A' 1046 ' ' MET . 3.1 t -78.4 -8.56 11.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.508 176.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.978 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.6 tt -70.92 -52.79 9.4 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 118.942 -0.552 . . . . 0.0 111.077 177.347 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.543 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 32.6 Cg_endo -66.64 -18.57 53.87 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.291 1.327 . . . . 0.0 111.123 173.069 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.89 -55.72 8.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.567 171.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.6 m -171.34 -36.73 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.101 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.613 HG22 ' HB ' ' A' ' 984' ' ' ILE . 6.9 m -58.04 -17.18 16.03 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -171.008 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.978 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 5.3 p-80 -48.46 -19.59 0.34 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.811 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 -75.53 -55.19 5.91 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.874 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.991 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -79.41 -40.17 30.68 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.29 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.613 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.7 tp -54.62 -35.89 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.719 -172.764 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 9.0 pt-20 -76.33 -38.19 56.3 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.884 176.728 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.754 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 3.6 ptp -59.37 -50.74 72.79 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.832 -173.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.679 ' N ' ' HG3' ' A' ' 986' ' ' MET . . . -78.58 -37.4 42.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.461 -176.434 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.975 ' HA ' HD11 ' A' ' 991' ' ' LEU . 1.4 tm0? -61.86 -40.59 95.88 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.297 -177.255 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 38.6 mmtm -59.54 -40.69 88.03 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 173.663 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -68.27 -36.07 78.85 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.896 -179.168 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.975 HD11 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -59.97 -49.38 77.91 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.183 0.516 . . . . 0.0 110.33 178.583 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -54.4 -42.82 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.797 -178.184 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 63.0 m -74.69 -38.87 62.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.175 -176.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.526 ' OD2' ' HB3' ' A' 1027 ' ' ALA . 1.0 OUTLIER -89.33 -39.59 13.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -169.784 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.894 ' HB2' HD12 ' A' ' 962' ' ' LEU . 1.5 tm? -61.08 -31.43 71.1 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 168.744 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.68 -50.0 75.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.594 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.63 -32.36 71.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.807 174.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 1.013 HD22 ' HA ' ' A' 1025 ' ' ALA . 0.2 OUTLIER -65.77 -34.52 78.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.888 0.375 . . . . 0.0 110.463 175.668 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.463 HG21 ' HE2' ' A' 1002 ' ' MET . 78.0 mt -61.99 -35.7 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.585 0.707 . . . . 0.0 109.385 174.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.702 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.3 m-80 -85.46 -13.16 50.06 Favored 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.507 176.631 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.874 ' HG2' ' HB2' ' A' 1021 ' ' MET . 0.1 OUTLIER -68.76 -40.18 79.87 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.049 0.452 . . . . 0.0 110.251 175.963 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.994 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.8 ptt? -78.64 -34.17 46.66 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 81.4 tttt -73.48 -55.71 5.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.95 -177.416 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.626 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.1 mp -54.42 -45.16 72.92 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.7 84.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.176 0.512 . . . . 0.0 110.067 177.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.883 ' HG3' HG11 ' A' ' 952' ' ' VAL . 15.5 mm100 -78.69 -9.8 59.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.799 0.809 . . . . 0.0 112.09 178.52 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.587 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.3 tp-100 -77.91 -43.76 29.04 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.439 175.798 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.403 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 2.9 t80 . . . . . 0 C--N 1.324 -0.535 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.311 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 121.275 0.56 . . . . 0.0 110.68 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.45 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.9 pt20 -55.15 -33.89 63.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.196 -169.375 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -50.77 -51.12 53.43 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 111.279 173.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.403 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.1 m-30 -76.87 -21.61 54.7 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.512 178.309 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.886 ' HG3' ' HE2' ' A' 1021 ' ' MET . 38.6 ttpt -65.27 -39.82 93.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.425 177.65 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.94 -57.06 13.17 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.319 0.58 . . . . 0.0 109.885 176.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -48.85 -49.7 38.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.461 176.161 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.886 ' HE2' ' HG3' ' A' 1018 ' ' LYS . 0.0 OUTLIER -73.81 -19.0 60.88 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.435 -176.759 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.55 -48.09 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.2 m -63.93 -33.76 76.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.361 177.301 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -62.93 -33.6 75.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 178.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 1.013 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -69.69 -31.28 69.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 178.923 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.532 ' O ' HG21 ' A' 1030 ' ' VAL . 22.5 t-80 -64.88 -34.59 78.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.379 176.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.526 ' HB3' ' OD2' ' A' ' 994' ' ' ASP . . . -57.57 -46.94 83.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.054 175.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.835 HD12 ' HG ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -62.49 -46.27 89.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.88 0.847 . . . . 0.0 110.554 177.39 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.81 -36.98 68.05 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.732 -179.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' 1026 ' ' HIS . 88.6 t -65.9 -35.7 75.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 173.283 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.669 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.72 -39.21 73.52 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.108 -178.478 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.71 -53.43 56.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.073 171.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.585 ' O ' ' HG ' ' A' 1036 ' ' LEU . 2.9 tmtp? -60.32 -48.21 82.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.048 -174.195 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.606 ' O ' HG21 ' A' 1038 ' ' VAL . 8.9 t30 -64.86 -36.53 84.64 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.823 -176.016 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.874 HD21 HD13 ' A' ' 991' ' ' LEU . 15.4 tp -78.98 -33.18 45.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 119.694 -0.193 . . . . 0.0 110.516 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.868 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.2 pp -67.64 -18.35 64.93 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 120.961 0.41 . . . . 0.0 109.899 -178.967 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -88.73 -38.91 14.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.222 169.771 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.991 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -50.68 -61.56 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.938 173.136 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.868 HD11 ' HA ' ' A' 1036 ' ' LEU . 1.7 pp -78.58 -24.22 13.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.125 -178.136 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.748 ' H ' HD12 ' A' 1039 ' ' ILE . 13.8 t0 -59.56 -36.18 75.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 164.809 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.588 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.8 mm-40 -72.57 -36.58 68.23 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.678 170.695 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.699 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -51.66 -53.22 41.2 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 123.223 0.327 . . . . 0.0 111.241 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.915 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 7.7 ppt_? -52.42 -38.99 60.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.699 176.009 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.647 ' N ' ' HD2' ' A' 1043 ' ' ARG . 48.2 tp -80.47 -23.42 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 121.001 -0.279 . . . . 0.0 111.29 177.487 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.732 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 28.5 mmmt -62.95 -42.68 99.89 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.668 0.747 . . . . 0.0 109.062 176.077 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.47 ' HB2' HG11 ' A' ' 975' ' ' VAL . 1.6 tmt? -61.84 -39.19 90.98 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.191 175.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.505 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 37.4 mm -61.05 -36.6 73.59 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.255 173.618 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.0 t -62.4 -21.9 65.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.869 0.366 . . . . 0.0 111.04 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.071 178.615 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.729 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 20.5 tpt180 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 18.3 m 70.88 5.57 5.51 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 123.073 0.549 . . . . 0.0 110.646 -177.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.505 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.5 OUTLIER 55.67 78.15 0.2 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.317 171.981 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.512 ' CG ' ' HG3' ' A' 1043 ' ' ARG . 2.4 p30 -55.03 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 112.356 -2.202 . . . . 0.0 112.257 -176.006 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.547 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 3.4 tmtp? -25.38 -25.24 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.238 1.415 . . . . 0.0 114.384 177.092 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.843 HG21 ' HG2' ' A' 1043 ' ' ARG . 13.4 m -62.79 -52.79 55.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 174.263 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 60.9 t80 -77.59 -31.17 52.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.163 0.982 . . . . 0.0 108.586 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.493 ' O ' ' HB ' ' A' ' 930' ' ' THR . 39.8 mt-10 -68.0 -49.77 59.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.931 -179.407 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.547 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 41.3 t30 -73.96 -30.33 62.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.669 HG22 HD13 ' A' ' 965' ' ' LEU . 45.2 t -64.75 -42.39 94.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.811 173.25 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.708 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.7 m -50.57 -29.4 10.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.204 0.526 . . . . 0.0 110.007 165.397 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . 0.405 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -70.77 -27.97 71.52 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.822 178.125 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.729 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 6.2 tt -64.61 -45.58 86.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.033 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 937' ' ' ILE . 35.2 t -57.04 -45.69 84.05 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.726 173.214 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.708 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.9 mmpt? -56.21 -45.5 79.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.701 178.117 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.715 ' HB2' ' HB1' ' A' ' 961' ' ' ALA . . . -77.48 -26.08 51.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.866 -177.41 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.4 p -80.44 -15.76 12.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.466 172.895 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.667 HG12 ' O ' ' A' ' 933' ' ' VAL . 25.0 mm -69.19 -28.06 37.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.479 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.51 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 11.1 mm-40 -62.49 -47.05 85.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.256 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.51 ' HE1' ' HE1' ' A' ' 954' ' ' MET . 24.1 ttt -57.05 -38.44 73.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.704 174.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.61 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 19.5 m -67.29 -40.73 86.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.127 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.5 t -76.43 -42.78 42.89 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -177.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 7.6 mmtm -48.45 -56.18 8.94 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 113.534 -1.666 . . . . 0.0 111.293 175.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.671 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.4 tt -66.61 -25.26 34.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 123.651 0.594 . . . . 0.0 112.006 -173.518 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.753 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 81.4 mm-40 -51.92 -59.54 8.01 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 119.44 -0.314 . . . . 0.0 111.777 -179.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.753 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.0 Cg_endo -100.64 14.9 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.631 1.554 . . . . 0.0 113.555 174.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -75.75 137.59 70.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -174.341 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 950' ' ' GLU . 93.3 Cg_endo -85.63 178.74 4.22 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 123.141 2.561 . . . . 0.0 109.47 160.05 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.609 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 8.5 Cg_endo -51.45 -36.66 59.64 Favored 'Trans proline' 0 C--O 1.247 0.97 0 C-N-CA 122.479 2.119 . . . . 0.0 111.943 176.572 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -59.44 -16.16 21.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.582 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.561 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -114.36 -9.49 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.558 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.709 ' O ' ' HG2' ' A' ' 954' ' ' MET . 24.4 m-85 -58.65 -41.83 86.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.584 0.706 . . . . 0.0 109.523 172.702 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -73.68 -52.04 5.01 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.374 177.236 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.2 Cg_exo -56.04 -27.46 64.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.963 1.775 . . . . 0.0 115.152 173.262 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.709 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 24.8 ptt? -68.5 -42.98 77.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.676 0.751 . . . . 0.0 109.601 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.755 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.3 t -71.32 -24.73 24.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.581 174.739 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 48.0 tttm -56.47 -43.56 79.69 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 173.469 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.425 ' HB3' ' HB2' ' A' ' 938' ' ' GLU . 4.5 mm-40 -54.05 -47.87 71.17 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.106 173.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.575 HG12 ' O ' ' A' ' 955' ' ' VAL . 4.5 p -69.94 -21.12 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.116 177.936 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.568 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -63.59 -41.43 99.13 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 170.575 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 41.6 tp -73.74 -10.18 59.42 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.248 0.547 . . . . 0.0 110.275 175.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.729 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -76.14 -56.4 4.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.468 -177.774 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 59.7 tp -76.02 -17.15 59.8 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.844 0.355 . . . . 0.0 110.43 175.399 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.729 ' HE ' ' HA ' ' A' ' 963' ' ' ARG . 0.3 OUTLIER -64.71 -65.76 0.63 Allowed 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.472 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.1 m -58.52 -22.09 54.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.353 175.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.669 HD13 HG22 ' A' ' 929' ' ' VAL . 19.8 tp -75.4 -36.81 60.8 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.5 -33.99 56.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.829 172.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -58.46 -49.84 75.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.179 173.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.759 HG22 ' HA ' ' A' ' 925' ' ' VAL . 9.4 m -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.961 171.684 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.9 t -54.79 -32.02 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 122.384 -0.198 . . . . 0.0 110.715 174.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.473 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 10.6 t70 -69.17 -32.31 71.54 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.309 176.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.587 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 60.1 mm-40 -60.59 -57.86 10.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 122.294 1.045 . . . . 0.0 109.111 172.651 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.496 ' OG ' HG23 ' A' ' 980' ' ' THR . 41.3 t -66.52 -22.69 66.17 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.341 -1.3 . . . . 0.0 112.264 -178.003 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.763 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.1 tp -61.67 -48.61 89.44 Favored Pre-proline 0 C--O 1.217 -0.644 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.082 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.714 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 31.5 Cg_exo -63.54 -26.87 69.71 Favored 'Trans proline' 0 C--N 1.356 0.933 0 CA-C-N 121.58 1.6 . . . . 0.0 110.683 167.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.683 HG12 ' HE2' ' A' 1045 ' ' LYS . 19.4 t -74.34 -12.63 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.545 176.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.763 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 0.7 OUTLIER -72.16 -54.0 6.06 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.128 177.778 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.744 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 24.4 Cg_exo -63.51 -22.61 70.93 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.392 1.395 . . . . 0.0 110.643 178.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -61.25 2.33 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.027 171.759 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 1.008 ' HB2' ' HD3' ' A' 1045 ' ' LYS . 29.0 m -161.07 -42.62 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.813 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.681 HG21 ' HB ' ' A' ' 984' ' ' ILE . 18.3 m -45.97 -21.1 0.11 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.14 1.534 . . . . 0.0 115.14 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.696 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 78.7 t60 -47.63 -36.48 10.96 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.726 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.574 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 4.9 ptp180 -61.52 -56.07 24.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.739 176.747 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.752 ' HG3' HG21 ' A' 1038 ' ' VAL . 0.6 OUTLIER -76.79 -49.33 16.13 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.141 -0.623 . . . . 0.0 112.025 -174.793 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.681 ' HB ' HG21 ' A' ' 980' ' ' THR . 11.2 tt -50.58 -42.29 21.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.376 -174.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -68.1 -30.17 69.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.982 -177.16 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.667 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.5 ptm -62.51 -57.1 12.39 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.121 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.92 -34.94 38.53 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -176.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.748 ' HA ' HD11 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -55.48 -52.68 62.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.951 0.405 . . . . 0.0 110.44 -177.407 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.427 ' HZ3' ' HB2' ' A' ' 989' ' ' LYS . 10.2 mtmp? -73.16 -23.91 60.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.64 . . . . 0.0 109.854 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.61 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 18.6 tp -65.9 -51.66 56.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.718 175.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' A' ' 988' ' ' GLN . 9.4 mt -53.08 -52.1 59.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.644 175.264 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -48.09 -43.05 30.36 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.358 178.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 50.4 m -65.02 -50.54 65.86 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.901 -178.001 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.622 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.3 m-20 -94.86 -25.41 16.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -169.271 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.568 HD22 ' HA2' ' A' ' 959' ' ' GLY . 2.9 tm? -52.84 -55.5 22.61 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.859 0.754 . . . . 0.0 109.265 165.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -52.71 -41.16 63.68 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.639 173.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.825 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.5 mm-40 -58.04 -48.58 79.66 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 123.779 0.674 . . . . 0.0 109.782 178.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.774 HD22 ' HA ' ' A' 1025 ' ' ALA . 31.2 tp -72.32 -32.79 66.84 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.567 0.542 . . . . 0.0 110.252 -172.426 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.788 ' O ' ' HG2' ' A' 1002 ' ' MET . 37.6 mm -63.5 -56.29 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 122.678 1.227 . . . . 0.0 107.931 173.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.707 ' O ' ' HB2' ' A' 1004 ' ' LEU . 43.0 t30 -58.22 -13.5 5.18 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 113.825 -1.534 . . . . 0.0 112.458 172.047 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.825 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 71.5 mmtt -87.24 -40.42 14.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.223 0.919 . . . . 0.0 111.081 172.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.836 ' HE2' HG23 ' A' ' 952' ' ' VAL . 12.0 ptt? -61.89 -34.67 76.45 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.6 ttmt -70.91 -57.98 4.05 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 113.844 -1.525 . . . . 0.0 108.556 172.62 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.707 ' HB2' ' O ' ' A' 1000 ' ' ASN . 2.9 tt -48.33 -57.88 5.38 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.714 0.634 . . . . 0.0 111.589 -173.659 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.1 -48.37 81.99 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.078 0.466 . . . . 0.0 110.562 -175.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.5 ' OE1' ' HA ' ' A' ' 948' ' ' PRO . 29.2 mm-40 -79.11 -15.32 58.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.112 -176.451 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.729 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.0 tp-100 -87.09 -37.94 16.94 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.417 177.851 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.496 ' HD2' ' CG ' ' A' 1017 ' ' TYR . 19.7 t80 . . . . . 0 C--N 1.313 -0.987 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.854 -176.428 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.436 ' NE2' ' O ' ' A' 1014 ' ' GLN . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.574 ' OE1' ' HD3' ' A' 1018 ' ' LYS . 6.0 tp-100 -51.37 -35.38 38.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.584 -177.077 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.523 ' HA ' ' HE3' ' A' 1019 ' ' LYS . 2.6 tp10 -56.54 -59.62 4.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.338 0.589 . . . . 0.0 111.483 171.589 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' 1017 ' ' TYR . 0.1 OUTLIER -50.06 -39.39 41.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.711 177.466 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.574 ' HD3' ' OE1' ' A' 1015 ' ' GLN . 86.4 tttt -60.98 -31.58 71.17 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.693 -1.14 . . . . 0.0 113.136 177.244 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' 1016 ' ' GLU . 89.8 mttt -58.5 -48.98 79.01 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.639 0.733 . . . . 0.0 109.23 177.028 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -51.96 -43.05 63.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.378 177.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.7 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 14.1 tmm? -65.12 -48.24 74.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.798 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.81 -32.85 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 -175.379 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 30.2 m -68.88 -47.06 66.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.081 0.467 . . . . 0.0 110.202 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.7 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -64.51 -35.62 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.271 177.888 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.774 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -60.87 -42.1 97.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.131 0.491 . . . . 0.0 110.446 176.132 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.562 ' O ' HG23 ' A' 1030 ' ' VAL . 58.1 t60 -69.14 -33.16 73.01 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.138 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.37 -46.92 84.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.119 176.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.538 HD11 ' N ' ' A' ' 995' ' ' LEU . 17.9 tp -59.72 -47.2 86.59 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.268 0.556 . . . . 0.0 110.27 177.206 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -54.69 -32.33 59.28 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.258 174.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' 1026 ' ' HIS . 89.9 t -72.46 -40.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 122.076 -0.39 . . . . 0.0 110.546 172.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.622 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 28.0 m-20 -57.7 -47.16 83.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.697 173.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' 1036 ' ' LEU . . . -52.74 -39.45 62.16 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.292 169.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' 1036 ' ' LEU . 35.2 tttm -71.93 -35.08 69.53 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.375 -176.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.585 ' O ' HG22 ' A' 1038 ' ' VAL . 66.2 t30 -70.8 -54.51 11.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 -178.831 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.843 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 15.2 tp -64.02 -28.35 69.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' 1040 ' ' ASP . 55.1 tp -51.37 -44.35 62.08 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.685 174.03 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.581 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 19.4 t70 -91.45 -26.92 18.61 Favored 'General case' 0 C--O 1.22 -0.461 0 O-C-N 124.105 0.878 . . . . 0.0 110.692 -179.345 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.843 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 25.2 t -57.42 -57.46 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 123.12 0.568 . . . . 0.0 111.967 177.04 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.743 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 7.9 pt -86.92 -27.37 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.947 -178.11 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.581 ' HB3' ' HA ' ' A' 1037 ' ' ASP . 2.4 t70 -44.21 -48.38 9.32 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 157.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.663 ' HA ' ' HB3' ' A' 1044 ' ' LEU . 23.4 tt0 -78.23 -23.84 47.24 Favored 'General case' 0 C--O 1.192 -1.936 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.494 176.428 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.84 ' O ' ' HG3' ' A' 1045 ' ' LYS . . . -56.29 -47.36 78.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.619 0.723 . . . . 0.0 111.504 175.632 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.843 ' HG2' HG21 ' A' ' 925' ' ' VAL . 5.9 mmm180 -79.46 -23.68 42.91 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.469 -0.769 . . . . 0.0 110.917 177.11 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.663 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.0 tp -78.38 -29.2 47.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.096 0.474 . . . . 0.0 110.498 175.474 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 1.008 ' HD3' ' HB2' ' A' ' 979' ' ' SER . 0.1 OUTLIER -71.42 -25.7 62.44 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 176.518 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 59.7 ttp -73.89 -28.69 61.68 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.603 175.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.463 ' HB ' ' O ' ' A' 1044 ' ' LEU . 45.0 mm -69.89 -32.8 53.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 168.232 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.739 ' HB2' ' O ' ' A' 1045 ' ' LYS . 44.0 m -57.56 -23.75 52.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.245 172.541 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 . . . . . 0 C--N 1.329 -0.306 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.128 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.773 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 21.1 tpt180 . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.421 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 47.9 m -61.22 126.55 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 164.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.1 OUTLIER -64.29 84.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.529 0.681 . . . . 0.0 112.475 -170.599 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.732 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.1 t70 -47.04 -174.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.75 -174.902 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.45 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.9 tmtm? -36.03 -27.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.146 0.978 . . . . 0.0 111.96 -179.869 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.841 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 3.3 m -55.32 -53.64 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-O 119.16 -0.448 . . . . 0.0 112.049 175.19 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.495 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 23.5 t80 -75.74 -33.92 60.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.634 -174.091 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -46.36 75.53 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.585 -173.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.5 ' ND2' ' HA ' ' A' ' 965' ' ' LEU . 4.1 t30 -73.97 -38.99 64.01 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.677 -174.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.596 HG22 ' CD2' ' A' ' 965' ' ' LEU . 12.0 t -65.24 -33.62 64.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.403 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.478 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 3.9 p -72.73 -27.44 62.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 171.095 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . 0.426 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -60.78 -30.61 73.15 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.342 167.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.79 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 3.7 tt -62.86 -38.2 89.89 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 174.901 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.532 ' O ' HG13 ' A' ' 937' ' ' ILE . 70.3 t -65.27 -41.37 91.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.495 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.578 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.2 mmpt? -60.72 -33.69 73.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.013 0.435 . . . . 0.0 110.284 177.458 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.694 ' HB1' ' HB3' ' A' ' 961' ' ' ALA . . . -78.97 -26.21 43.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.562 -178.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.539 ' HA ' HG13 ' A' ' 958' ' ' VAL . 12.9 p -82.87 -12.05 12.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.792 0.806 . . . . 0.0 109.334 171.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 59.2 mt -70.55 -41.26 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.092 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.648 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 56.5 mm-40 -53.74 -43.09 68.85 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.038 169.747 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.574 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 24.7 ttt -58.29 -41.15 83.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.562 177.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.69 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 40.6 m -67.83 -41.23 83.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.923 -179.764 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.486 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 11.8 p -76.39 -40.62 50.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -175.104 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 954' ' ' MET . 7.8 mmtp -53.63 -49.58 67.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.126 178.829 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.834 ' HB ' ' HE1' ' A' ' 954' ' ' MET . 17.5 tt -71.28 -27.75 30.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.785 -173.437 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.807 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 91.9 mt-30 -56.42 -63.21 3.66 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.42 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.807 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.6 Cg_endo -97.34 -12.12 0.49 Allowed 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.451 1.434 . . . . 0.0 114.378 -175.333 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.446 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -95.86 152.28 38.92 Favored Pre-proline 0 C--N 1.323 -0.573 0 O-C-N 122.073 -0.392 . . . . 0.0 112.007 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 2.8 Cg_exo -76.89 178.7 7.29 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.584 2.856 . . . . 0.0 112.432 -178.212 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.717 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 50.0 Cg_exo -55.88 -27.32 62.37 Favored 'Trans proline' 0 C--O 1.245 0.852 0 C-N-CA 122.821 2.347 . . . . 0.0 112.561 176.233 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -55.73 -27.45 50.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.047 173.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.447 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -102.03 -5.1 24.97 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.342 175.782 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.766 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 6.8 m-30 -56.45 -43.71 79.76 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.515 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.07 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -74.68 -51.8 3.87 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 119.97 -0.692 . . . . 0.0 112.159 176.689 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.993 ' HD3' HG12 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.86 -32.89 48.8 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.167 1.911 . . . . 0.0 113.972 173.632 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.834 ' HE1' ' HB ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -60.02 -54.91 40.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.878 0.847 . . . . 0.0 110.633 178.553 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.823 ' HB ' ' HB3' ' A' 1002 ' ' MET . 94.2 t -63.22 -26.5 41.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.151 172.539 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 19.2 tptm -65.01 -27.26 68.7 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.046 177.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -59.33 -46.51 88.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.308 172.057 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.838 HG23 HD22 ' A' ' 998' ' ' LEU . 2.5 m -72.29 -24.08 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.24 175.869 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.506 ' HA2' HD23 ' A' ' 995' ' ' LEU . . . -71.02 -43.51 57.16 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.265 -0.969 . . . . 0.0 111.141 176.521 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.88 -33.16 68.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.246 170.263 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.79 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -58.86 -56.48 21.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.32 179.841 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 991' ' ' LEU . 6.9 tt -71.43 -31.62 67.43 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.506 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.07 -55.51 34.04 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.815 -0.553 . . . . 0.0 111.148 171.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 m -58.78 -33.02 69.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.525 0.679 . . . . 0.0 110.339 174.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.63 HD21 HD21 ' A' 1035 ' ' LEU . 1.8 tm? -63.53 -34.12 77.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.291 174.512 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 35.6 tp -62.46 -25.81 68.18 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.348 178.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.96 -43.05 84.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.175 0.512 . . . . 0.0 110.085 171.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.665 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 6.9 m -61.89 -37.44 84.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.294 173.82 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 965' ' ' LEU . 97.5 t -58.14 -31.25 41.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.115 174.457 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.47 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 22.0 t70 -76.79 -23.61 52.88 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.067 0.46 . . . . 0.0 110.824 178.405 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.531 ' O ' HG21 ' A' ' 975' ' ' VAL . 63.8 mm-40 -70.52 -53.71 15.07 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.379 1.085 . . . . 0.0 108.839 169.7 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.704 ' OG ' HG23 ' A' ' 980' ' ' THR . 40.8 t -66.95 -25.95 66.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.149 -178.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.692 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 57.3 tp -62.59 -53.21 59.15 Favored Pre-proline 0 C--O 1.218 -0.595 0 CA-C-O 118.863 -0.589 . . . . 0.0 112.297 -176.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.1 Cg_exo -54.86 -32.22 76.48 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 120.928 1.367 . . . . 0.0 111.297 169.193 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.561 HG13 ' HG1' ' A' ' 980' ' ' THR . 2.8 t -77.46 -10.47 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.591 177.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.733 ' HG ' ' CB ' ' A' ' 981' ' ' HIS . 2.3 tt -65.59 -53.2 38.84 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.182 176.761 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.62 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 37.6 Cg_exo -61.87 -33.55 84.17 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.353 1.369 . . . . 0.0 110.842 173.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.96 27.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.918 175.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 8.7 m -170.73 -26.95 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -177.601 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.751 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 37.2 m -63.2 -20.92 65.86 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 -170.613 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.733 ' CB ' ' HG ' ' A' ' 976' ' ' LEU . 1.8 p80 -50.79 -21.91 1.89 Allowed 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -171.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -69.2 -54.5 14.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 119.883 -0.727 . . . . 0.0 110.535 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 1.006 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.99 -43.07 30.66 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.662 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.605 ' HB ' HG21 ' A' ' 980' ' ' THR . 10.6 tp -60.23 -29.14 43.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.512 -175.031 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.37 -36.67 63.57 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.426 172.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.546 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 20.6 ptm -68.92 -52.73 26.3 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.991 -175.767 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.733 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.19 -46.22 21.05 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.487 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 1.018 ' HA ' HD12 ' A' ' 991' ' ' LEU . 23.2 tp60 -60.64 -37.56 81.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.291 -175.126 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -59.6 -41.94 91.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.737 0.78 . . . . 0.0 109.173 174.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' A' ' 987' ' ' ALA . 0.1 OUTLIER -72.77 -35.68 67.5 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.973 179.417 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 1.018 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.0 mt -60.72 -50.13 74.71 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.626 0.727 . . . . 0.0 109.837 179.164 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.429 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 26.6 t-20 -56.67 -41.87 78.01 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.235 -175.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.484 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 11.5 p -75.54 -33.2 60.66 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -178.248 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.09 -41.87 10.26 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -171.327 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.79 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.6 OUTLIER -59.56 -39.11 82.95 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 171.141 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.429 ' HB1' ' O ' ' A' ' 992' ' ' ASN . . . -54.86 -48.93 72.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.771 178.251 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 993' ' ' SER . 62.6 mm-40 -57.61 -38.93 75.76 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.373 179.434 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.838 HD22 HG23 ' A' ' 958' ' ' VAL . 14.9 tp -70.39 -29.8 66.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.089 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.737 HG23 ' HE3' ' A' 1002 ' ' MET . 44.4 mt -61.82 -35.75 69.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.893 173.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.65 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 41.9 m-80 -88.42 -5.5 58.23 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.101 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 5.2 mptp? -86.19 -34.64 20.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 174.687 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.07 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.9 ptt? -73.47 -35.95 65.77 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 171.978 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.771 ' O ' ' HB2' ' A' 1007 ' ' GLN . 87.3 tttt -62.27 -56.89 14.1 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.213 174.663 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.64 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.0 mp -64.97 -35.79 82.33 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 178.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -63.31 -47.36 82.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.899 0.857 . . . . 0.0 109.851 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -8.4 56.88 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.196 177.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.771 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.0 tp-100 -90.42 -21.18 22.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.397 178.561 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 77.9 t80 . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.807 -174.876 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.224 -0.254 0 CA-C-O 120.77 0.319 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.563 ' O ' ' HG2' ' A' 1019 ' ' LYS . 27.3 pt20 -55.32 -33.9 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.561 -176.412 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.6 tt0 -50.19 -49.17 53.39 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 170.893 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1017 ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -80.04 -14.6 58.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 179.228 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.466 ' HB3' ' O ' ' A' 1015 ' ' GLN . 56.8 tttp -68.63 -36.19 78.28 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 171.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' 1015 ' ' GLN . 32.5 mmtp -68.67 -55.26 12.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.457 176.396 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' 1016 ' ' GLU . 49.5 mm-40 -48.37 -38.42 19.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.849 173.11 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.458 ' HB3' ' O ' ' A' 1018 ' ' LYS . 37.8 ttm -58.79 -57.47 12.86 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 176.346 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.49 -34.97 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -179.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 61.8 m -60.71 -40.17 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.873 177.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.42 ' HB1' ' HE3' ' A' 1001 ' ' LYS . . . -78.69 -31.28 46.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.507 179.201 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.545 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -65.15 -41.12 95.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.2 176.348 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.636 ' O ' HG22 ' A' 1030 ' ' VAL . 12.8 t-80 -63.84 -40.0 95.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.949 174.177 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.87 -45.94 80.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.07 -179.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.79 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.1 -28.77 64.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.504 0.668 . . . . 0.0 110.232 178.204 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.474 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.63 -41.43 85.94 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.682 -0.636 . . . . 0.0 109.694 171.483 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' 1026 ' ' HIS . 48.1 t -59.95 -30.75 46.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.468 174.167 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.452 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -76.5 -40.93 48.76 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 109.804 178.723 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.45 -52.64 64.77 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 121.252 0.549 . . . . 0.0 110.718 175.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.579 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 19.7 pttp -65.89 -32.18 73.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -172.055 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.522 ' O ' HG23 ' A' 1038 ' ' VAL . 64.9 t30 -73.6 -35.69 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.139 179.551 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.792 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -76.33 -32.5 58.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 -178.154 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.855 ' HA ' HD12 ' A' 1039 ' ' ILE . 4.4 pp -66.54 -23.61 66.25 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.27 -39.53 25.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.566 169.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 1.006 HG12 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -53.58 -65.41 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.117 -0.947 . . . . 0.0 112.792 175.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.855 HD12 ' HA ' ' A' 1036 ' ' LEU . 1.5 pp -74.86 -27.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.348 -177.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.799 ' H ' HD13 ' A' 1039 ' ' ILE . 11.7 t70 -50.35 -45.56 55.18 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.268 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.734 ' O ' ' HG2' ' A' 1045 ' ' LYS . 47.6 mt-30 -76.75 -28.69 55.84 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.031 176.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.686 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.84 -55.98 19.15 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.973 0.806 . . . . 0.0 111.729 176.536 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.773 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 1.4 mpt_? -58.49 -31.37 67.8 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.924 174.433 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.1 tp -76.38 -20.91 56.7 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.848 175.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.2 mmtt -67.41 -32.66 73.71 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.151 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 15.5 tmm? -69.12 -37.43 78.34 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.795 176.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.484 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 49.2 mm -65.47 -37.77 80.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.919 172.82 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.436 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.3 m -58.07 -42.62 85.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.721 177.492 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.852 178.594 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.411 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 15.0 tpt180 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 28.1 t -85.04 84.37 7.74 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.616 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.512 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -11.61 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.065 1.746 . . . . 0.0 114.114 -175.459 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.859 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 2.2 t0 -47.22 -173.4 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 112.552 -2.113 . . . . 0.0 113.275 -174.238 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.472 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.4 tmtp? -37.25 -24.7 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.922 -1.035 . . . . 0.0 112.209 177.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.809 HG11 HG23 ' A' ' 968' ' ' THR . 5.3 m -56.45 -52.15 56.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 122.615 0.366 . . . . 0.0 111.899 172.955 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.55 ' HD1' ' CD2' ' A' 1036 ' ' LEU . 4.8 t80 -68.88 -29.58 67.9 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -178.173 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 6.3 mm-40 -68.39 -65.55 0.68 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.092 -1.413 . . . . 0.0 113.374 -173.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.687 HD22 ' HB ' ' A' ' 968' ' ' THR . 22.0 p-10 -73.24 -30.73 63.67 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.503 -172.556 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.645 HG21 ' CD1' ' A' ' 965' ' ' LEU . 45.9 t -64.02 -37.15 79.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.335 177.204 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.549 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 12.2 p -73.28 -28.02 61.88 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 171.275 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . 0.519 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -58.52 -28.27 62.15 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 114.699 -1.137 . . . . 0.0 112.546 169.18 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 965' ' ' LEU . 3.7 tt -66.02 -44.58 84.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.542 ' O ' HG12 ' A' ' 937' ' ' ILE . 66.1 t -57.81 -38.06 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.588 172.193 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 930' ' ' THR . 9.8 mmpt? -62.96 -36.12 82.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 175.738 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.666 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.94 -25.81 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.642 -179.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.551 ' HA ' HG11 ' A' ' 958' ' ' VAL . 14.5 p -81.6 -16.41 12.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.558 172.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 933' ' ' VAL . 47.6 mm -69.26 -37.48 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 165.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.2 mm-40 -53.87 -37.38 63.63 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.704 171.367 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.648 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 59.6 ttp -58.87 -45.65 89.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.579 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 31.8 m -71.87 -28.62 63.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 178.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.586 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.0 m -77.36 -41.17 41.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.138 0.971 . . . . 0.0 108.391 -176.48 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.516 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.8 mmtp -59.22 -42.07 90.13 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 113.532 -1.667 . . . . 0.0 111.955 179.318 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.447 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.6 tt -71.66 -24.55 23.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.065 -176.168 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.769 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 76.4 mt-30 -55.82 -62.68 4.2 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.769 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -100.49 12.25 0.52 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.749 1.633 . . . . 0.0 114.26 -176.103 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.477 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -131.47 155.24 81.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.712 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.3 Cg_endo -93.21 -169.37 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 123.886 3.058 . . . . 0.0 112.701 -177.304 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.712 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 94.7 Cg_exo -49.51 -32.8 28.4 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.282 2.655 . . . . 0.0 113.559 176.464 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.532 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 73.4 mm-40 -53.63 -20.9 5.83 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.917 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.507 ' C ' ' HD2' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -118.73 -6.86 10.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.565 -178.591 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 1.024 ' HA ' ' HE1' ' A' ' 954' ' ' MET . 2.9 m-85 -55.98 -48.55 75.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.136 0.494 . . . . 0.0 109.951 175.139 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 1.049 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.09 -44.69 3.75 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 119.106 -1.037 . . . . 0.0 111.702 176.829 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 1.049 ' HD3' HG12 ' A' ' 952' ' ' VAL . 89.4 Cg_exo -55.16 -27.98 58.83 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.597 2.198 . . . . 0.0 115.462 172.28 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 1.024 ' HE1' ' HA ' ' A' ' 951' ' ' TYR . 18.6 ptp -69.33 -44.78 70.97 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.182 0.991 . . . . 0.0 108.764 175.853 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.754 ' CG1' ' HA ' ' A' ' 999' ' ' ILE . 59.4 t -59.91 -27.66 39.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.912 169.547 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.5 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 27.6 ttpt -66.39 -33.13 75.02 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.684 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 954' ' ' MET . 5.0 mm-40 -56.06 -45.46 79.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.573 175.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 955' ' ' VAL . 2.8 m -70.51 -24.99 26.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.266 175.293 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.39 -43.79 36.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.824 177.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.9 -24.87 68.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.088 0.471 . . . . 0.0 109.903 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.615 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -65.57 -49.8 67.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.334 173.307 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.846 ' HB2' ' HG ' ' A' ' 995' ' ' LEU . 18.0 tp -59.83 -40.71 89.37 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 172.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -54.87 -55.58 28.89 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.001 0.429 . . . . 0.0 111.15 172.323 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 44.0 m -55.67 -42.44 75.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.723 0.773 . . . . 0.0 110.43 174.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.645 ' CD1' HG21 ' A' ' 929' ' ' VAL . 9.9 tp -54.53 -40.13 68.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.834 176.248 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.85 -33.38 71.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.77 -178.645 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.68 86.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.104 0.478 . . . . 0.0 110.261 175.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.809 HG23 HG11 ' A' ' 925' ' ' VAL . 0.8 OUTLIER -70.65 -34.05 71.63 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.825 175.401 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.7 t -55.81 -30.28 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 173.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.568 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 24.2 t70 -80.85 -29.52 35.81 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 177.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.3 mm-40 -69.41 -42.82 74.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 123.114 1.435 . . . . 0.0 108.186 171.167 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.996 ' HA ' HG21 ' A' ' 975' ' ' VAL . 33.2 t -68.01 -22.73 64.97 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 113.29 -1.777 . . . . 0.0 111.673 174.515 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.5 tt -58.45 -53.46 65.91 Favored Pre-proline 0 C--O 1.213 -0.854 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.082 179.199 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.61 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 43.5 Cg_exo -59.73 -34.72 95.99 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-N 121.419 1.542 . . . . 0.0 111.911 173.178 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.996 HG21 ' HA ' ' A' ' 972' ' ' SER . 19.7 m -77.23 -10.12 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 118.975 -1.09 . . . . 0.0 111.306 -178.613 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.892 ' HA ' ' HB ' ' A' ' 980' ' ' THR . 3.3 pp -81.98 -40.16 0.95 Allowed Pre-proline 0 CA--C 1.537 0.479 0 CA-C-O 118.307 -0.854 . . . . 0.0 113.187 -177.208 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.464 ' CD ' ' O ' ' A' ' 973' ' ' LEU . 44.1 Cg_endo -69.89 -27.22 26.1 Favored 'Trans proline' 0 C--N 1.36 1.177 0 CA-C-N 121.669 1.632 . . . . 0.0 109.662 172.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.26 9.19 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.554 172.336 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.72 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 18.4 m -167.94 -6.55 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.444 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.892 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 88.2 m -88.07 -23.24 23.79 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -169.643 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.563 ' HA ' HG22 ' A' ' 984' ' ' ILE . 19.8 t60 -50.72 -34.93 28.84 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.002 0.819 . . . . 0.0 111.435 -172.973 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -59.78 -52.95 63.26 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.738 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.721 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.1 tp10 -74.71 -47.95 28.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.92 -178.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.718 ' HA ' HG11 ' A' 1038 ' ' VAL . 8.4 tp -54.84 -38.77 45.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -173.261 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.423 ' OE1' ' HA ' ' A' ' 985' ' ' GLU . 5.2 mm-40 -73.13 -27.7 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.881 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.606 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 11.1 ptt? -63.5 -50.52 69.31 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.136 178.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.29 -42.63 22.73 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.745 -178.601 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.44 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 1.0 OUTLIER -61.59 -42.34 98.72 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.028 -173.306 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.541 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 11.0 tmtt? -65.55 -41.39 93.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 175.646 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.76 -50.48 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.167 177.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.617 HD23 HD23 ' A' ' 965' ' ' LEU . 2.9 pp -74.55 -29.32 61.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.761 0.315 . . . . 0.0 111.441 -175.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.48 ' N ' HD11 ' A' ' 991' ' ' LEU . 26.7 t-20 -58.14 -43.38 87.29 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.478 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.5 m -76.34 -27.34 56.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.193 -174.249 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -103.98 -44.76 4.93 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -170.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.981 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.77 -50.18 71.14 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.157 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.582 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -57.51 -45.69 84.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.825 176.796 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.73 -35.38 77.9 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.649 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 1.2 tm? -72.3 -36.21 68.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.903 -174.124 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.754 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 28.7 pt -65.45 -27.05 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.208 0.528 . . . . 0.0 110.46 177.226 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.601 ' O ' ' HB2' ' A' 1004 ' ' LEU . 53.2 m-80 -93.35 -6.14 47.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.692 175.737 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.649 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 20.9 tptt -85.31 -46.83 10.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -175.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.66 ' HE1' ' HE1' ' A' 1021 ' ' MET . 56.9 tpp -79.85 -32.91 40.51 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.36 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.752 ' O ' ' HB2' ' A' 1007 ' ' GLN . 41.7 ttmt -55.28 -49.06 73.06 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.118 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.601 ' HB2' ' O ' ' A' 1000 ' ' ASN . 28.9 tp -53.86 -50.9 65.24 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.901 0.751 . . . . 0.0 112.293 171.288 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.456 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -58.48 -46.45 86.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.251 0.548 . . . . 0.0 110.979 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.54 ' OE1' ' HB3' ' A' ' 948' ' ' PRO . 20.6 mm-40 -77.43 -7.61 56.44 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.314 178.286 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.752 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.2 tp-100 -89.82 -9.41 49.27 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.136 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 57.1 t80 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.068 -178.818 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.809 0.338 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.556 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 3.4 pt20 -67.81 -21.82 65.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.822 -175.033 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' 1019 ' ' LYS . 25.8 tt0 -57.89 -55.63 32.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.422 0.629 . . . . 0.0 109.521 174.967 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.479 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 5.7 m-30 -74.94 -15.17 60.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.1 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.556 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 39.3 ttpt -78.19 -42.53 31.19 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.154 -0.219 . . . . 0.0 110.582 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' 1016 ' ' GLU . 17.2 ptpt -69.04 -20.86 64.13 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.615 0.721 . . . . 0.0 109.405 176.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -78.64 -42.74 27.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.086 177.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.66 ' HE1' ' HE1' ' A' 1002 ' ' MET . 3.6 ppp? -74.91 -27.13 60.09 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.38 178.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.1 tp -63.56 -44.09 95.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.159 0.504 . . . . 0.0 110.21 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.1 m -65.87 -31.13 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.575 177.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.85 -35.16 44.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.17 -31.49 72.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.264 177.146 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.484 ' O ' HG22 ' A' 1030 ' ' VAL . 31.0 t60 -67.51 -34.05 76.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.772 174.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -75.76 -41.65 52.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.164 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.981 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.49 -32.05 67.81 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.337 0.589 . . . . 0.0 110.605 179.953 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.602 ' N ' HD22 ' A' 1028 ' ' LEU . . . -56.65 -38.67 72.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.142 0.496 . . . . 0.0 110.314 171.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.484 HG22 ' O ' ' A' 1026 ' ' HIS . 96.2 t -65.81 -34.2 68.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.052 174.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.554 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.6 p30 -72.76 -39.86 66.48 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.858 -172.546 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.515 ' HB3' HD22 ' A' ' 932' ' ' LEU . . . -61.05 -54.31 46.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.084 0.468 . . . . 0.0 110.444 174.459 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.415 ' HA ' ' HB3' ' A' 1036 ' ' LEU . 20.0 ttpt -71.74 -22.89 61.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.372 -173.291 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.467 ' O ' HG23 ' A' 1038 ' ' VAL . 9.7 t30 -73.94 -32.32 63.45 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.168 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.673 HD12 HD13 ' A' ' 984' ' ' ILE . 19.6 tp -76.46 -33.61 58.72 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.643 ' HA ' HD11 ' A' 1039 ' ' ILE . 0.0 OUTLIER -48.24 -42.56 30.71 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 174.733 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.633 ' N ' HD12 ' A' 1036 ' ' LEU . 23.1 t70 -72.39 -45.3 60.36 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.174 0.511 . . . . 0.0 110.057 177.147 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.721 HG13 ' HB3' ' A' ' 983' ' ' GLU . 40.8 t -48.32 -63.55 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.684 175.673 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.803 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -78.77 -29.01 14.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.098 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.746 ' H ' HD12 ' A' 1039 ' ' ILE . 1.0 OUTLIER -50.53 -48.49 57.19 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 166.09 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.742 ' O ' ' HG2' ' A' 1045 ' ' LYS . 22.7 mt-30 -74.78 -32.49 62.05 Favored 'General case' 0 C--O 1.2 -1.544 0 CA-C-N 113.413 -1.721 . . . . 0.0 111.22 175.592 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.784 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.28 -55.45 21.28 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 118.763 0.711 . . . . 0.0 112.109 178.778 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.859 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 4.0 tpt180 -54.65 -35.95 64.05 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.418 174.296 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.92 -26.17 59.43 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.297 175.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.742 ' HG2' ' O ' ' A' 1041 ' ' GLN . 73.2 mmtt -65.39 -32.79 74.6 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.701 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1046 ' ' MET . . . . . 0.458 ' HB2' HG12 ' A' ' 975' ' ' VAL . 1.7 tmt? -64.45 -40.02 94.93 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.811 175.759 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.11 -37.15 79.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.954 172.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A 1048 ' ' SER . . . . . 0.427 ' HB3' ' O ' ' A' 1045 ' ' LYS . 33.2 t -59.19 -37.52 77.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.107 0.48 . . . . 0.0 110.533 177.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A 1049 ' ' GLN . . . . . 0.439 HE21 ' HB3' ' A' 1049 ' ' GLN . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.302 178.835 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 920' ' ' ARG . . . . . 0.772 ' CD ' ' HB2' ' A' 1044 ' ' LEU . 4.1 ttt-85 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 33.5 m 60.31 15.36 5.33 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.868 0.467 . . . . 0.0 111.923 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 922' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 43.06 52.46 5.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 123.522 0.729 . . . . 0.0 110.845 -174.479 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 923' ' ' ASP . . . . . 0.497 ' CG ' ' H ' ' A' ' 924' ' ' LYS . 23.5 t0 -46.56 -175.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 O-C-N 125.638 1.837 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.645 ' HD2' ' HG1' ' A' ' 968' ' ' THR . 2.9 tmtm? -34.33 -25.23 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.032 0.933 . . . . 0.0 112.46 178.523 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.715 ' HA ' HG22 ' A' ' 968' ' ' THR . 4.5 m -56.52 -50.66 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 174.028 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.483 ' CE2' HD12 ' A' 1036 ' ' LEU . 27.2 t80 -76.94 -35.41 57.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -177.476 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.64 -53.65 54.93 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.607 -1.633 . . . . 0.0 111.546 -177.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.18 -44.99 86.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.203 -173.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.901 ' HB ' HD22 ' A' 1036 ' ' LEU . 16.6 t -60.92 -34.84 61.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.076 -0.649 . . . . 0.0 111.217 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.655 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 87.6 m -60.67 -39.37 88.15 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 173.137 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.61 70.01 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 114.982 -1.008 . . . . 0.0 113.318 174.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.883 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 10.8 tp -68.41 -35.0 77.01 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 109.51 176.361 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.547 ' O ' HG12 ' A' ' 936' ' ' VAL . 45.9 t -70.33 -38.56 74.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.3 0.571 . . . . 0.0 110.028 172.359 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.655 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -64.29 -25.35 68.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.462 177.23 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.592 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -75.37 -29.96 60.04 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.257 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.547 HG12 ' O ' ' A' ' 933' ' ' VAL . 10.2 p -79.7 -13.67 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.043 173.29 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 47.0 mm -73.37 -42.48 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 166.202 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.2 mm-40 -52.6 -41.94 64.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.222 169.273 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.523 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 14.4 ttt -59.09 -41.06 87.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.895 177.756 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 19.9 m -66.25 -37.07 84.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 941' ' ' SER . . . . . 0.475 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.1 m -77.67 -40.36 41.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -176.787 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 942' ' ' LYS . . . . . 0.699 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 5.6 mmtp -62.95 -40.02 96.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.457 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 943' ' ' ILE . . . . . 0.696 HD11 ' HB3' ' A' ' 946' ' ' ALA . 9.5 tp -73.98 -23.19 18.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 O-C-N 123.127 0.267 . . . . 0.0 111.216 -177.831 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 944' ' ' GLN . . . . . 0.64 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 77.6 mt-30 -53.52 -54.09 49.52 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.706 177.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 945' ' ' PRO . . . . . 0.64 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 63.1 Cg_endo -100.54 21.66 0.22 Allowed 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.999 1.799 . . . . 0.0 113.473 173.986 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 946' ' ' ALA . . . . . 0.699 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -89.21 128.57 51.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -173.289 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 947' ' ' PRO . . . . . 0.446 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 1.8 Cg_endo -84.99 179.2 4.32 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.465 2.777 . . . . 0.0 108.489 159.015 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 948' ' ' PRO . . . . . 0.567 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 7.1 Cg_endo -50.86 -34.64 46.02 Favored 'Trans proline' 0 C--O 1.245 0.829 0 C-N-CA 122.167 1.912 . . . . 0.0 111.731 178.061 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 949' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 17.8 mm-40 -55.6 -37.49 68.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.353 178.224 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 950' ' ' GLU . . . . . 0.563 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.8 mp0 -96.45 -5.55 39.36 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 178.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.567 ' CD1' ' HA ' ' A' ' 948' ' ' PRO . 10.6 m-85 -57.75 -42.12 83.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 172.713 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.927 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -71.79 -51.98 8.43 Favored Pre-proline 0 CA--C 1.555 1.14 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.246 177.168 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.927 ' HD3' HG13 ' A' ' 952' ' ' VAL . 96.8 Cg_exo -51.42 -41.06 61.4 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.734 2.29 . . . . 0.0 115.135 174.629 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.673 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 14.8 ptt? -60.21 -50.06 75.15 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.706 0.765 . . . . 0.0 110.093 -179.012 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.718 ' HB ' ' HB3' ' A' 1002 ' ' MET . 2.7 t -63.54 -26.82 41.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.785 174.302 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.411 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 39.1 ttmt -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.1 mm-40 -56.0 -46.96 78.58 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.45 174.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.996 HG22 HD21 ' A' ' 998' ' ' LEU . 3.1 m -68.66 -26.27 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.834 177.474 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.438 ' HA2' HD23 ' A' ' 998' ' ' LEU . . . -75.18 -44.11 23.92 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.061 -1.066 . . . . 0.0 112.58 -179.804 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.6 -25.03 64.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.912 0.387 . . . . 0.0 110.482 172.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.883 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.24 -52.98 59.94 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.069 174.645 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 1.035 ' HB2' HD21 ' A' ' 995' ' ' LEU . 18.0 tp -53.3 -44.92 68.7 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.055 0.389 . . . . 0.0 111.213 172.81 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 30.1 mmm180 -56.26 -54.87 40.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.954 0.407 . . . . 0.0 111.122 177.274 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.4 m -53.81 -43.21 69.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.464 0.65 . . . . 0.0 110.945 174.796 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.587 HD21 HD11 ' A' 1035 ' ' LEU . 36.6 tp -61.92 -37.11 83.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.598 179.157 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.0 tp -52.92 -36.56 59.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.182 178.097 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.06 95.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.151 0.5 . . . . 0.0 110.335 174.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.715 HG22 ' HA ' ' A' ' 925' ' ' VAL . 5.7 m -66.46 -34.02 77.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 174.239 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.634 HG13 HD13 ' A' ' 984' ' ' ILE . 73.3 t -55.25 -31.72 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.509 172.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.597 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.9 t70 -76.63 -22.78 53.65 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.242 177.72 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.654 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 50.7 mm-40 -68.99 -50.79 45.9 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 122.972 1.368 . . . . 0.0 108.587 170.128 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.628 ' OG ' HG22 ' A' ' 980' ' ' THR . 40.3 t -65.53 -24.93 67.24 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.34 177.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.683 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.3 tp -61.11 -48.87 90.83 Favored Pre-proline 0 C--O 1.217 -0.616 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.619 -176.319 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.654 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 32.3 Cg_exo -61.57 -27.98 82.45 Favored 'Trans proline' 0 C--N 1.355 0.876 0 CA-C-N 121.246 1.481 . . . . 0.0 110.578 170.24 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.488 HG21 ' O ' ' A' ' 971' ' ' GLU . 2.6 t -76.86 -10.31 13.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.496 175.676 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 976' ' ' LEU . . . . . 0.683 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 3.7 tt -68.04 -53.82 18.36 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.226 176.303 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 977' ' ' PRO . . . . . 0.587 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.5 Cg_exo -62.9 -24.32 74.22 Favored 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 121.437 1.425 . . . . 0.0 111.054 174.36 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -56.83 11.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.585 172.886 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 979' ' ' SER . . . . . 0.758 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 4.7 m -169.02 -33.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.975 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.707 HG23 ' HB ' ' A' ' 984' ' ' ILE . 8.3 m -54.99 -19.57 7.11 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -174.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.614 ' HA ' ' HG ' ' A' ' 976' ' ' LEU . 83.5 t60 -48.5 -20.12 0.4 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.363 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 23.6 ttt85 -77.4 -55.52 5.33 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.301 179.203 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.9 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.1 OUTLIER -79.57 -43.76 22.39 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.11 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.707 ' HB ' HG23 ' A' ' 980' ' ' THR . 7.9 tp -56.04 -37.86 50.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.796 -170.406 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 14.7 pt-20 -75.76 -40.71 54.84 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.146 177.034 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.74 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 13.8 ptp -61.25 -50.15 74.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.555 -173.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.6 -32.67 47.64 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.204 -177.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.38 -50.32 72.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.34 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -65.16 -32.03 73.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.351 0.596 . . . . 0.0 109.935 175.386 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.649 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.3 tp -61.14 -58.86 6.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.353 176.611 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.791 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 3.1 pp -70.86 -19.05 62.68 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.447 -176.728 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.492 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 6.7 t30 -59.61 -38.17 80.59 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 173.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.415 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 50.5 m -77.6 -30.47 52.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -178.832 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.64 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.4 m-20 -103.36 -27.49 12.4 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 119.629 -0.828 . . . . 0.0 112.4 -175.473 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.035 HD21 ' HB2' ' A' ' 962' ' ' LEU . 7.1 mp -71.8 -15.74 62.16 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 163.088 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . 0.588 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -68.88 -41.82 77.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.308 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 994' ' ' ASP . 7.8 mm-40 -58.26 -33.21 69.15 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.952 171.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.996 HD21 HG22 ' A' ' 958' ' ' VAL . 0.6 OUTLIER -58.33 -35.64 72.19 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.013 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.588 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 1.7 mp -60.24 -42.78 91.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.449 175.4 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.691 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 92.5 m-20 -77.69 -19.37 55.43 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.307 177.284 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.682 ' HD3' ' HA ' ' A' ' 998' ' ' LEU . 9.2 mtpm? -66.9 -44.53 80.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.165 0.507 . . . . 0.0 109.781 174.823 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.89 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 22.3 ptp -76.59 -36.38 57.57 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.775 ' O ' ' HB2' ' A' 1007 ' ' GLN . 23.4 tptm -67.5 -62.59 1.34 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.893 -179.335 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.855 HD22 ' HB3' ' A' 1017 ' ' TYR . 2.9 tt -52.19 -56.17 16.33 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.454 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.75 -53.59 56.14 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.301 -174.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -17.99 64.6 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.169 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.775 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.8 tp-100 -88.56 -38.45 14.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.469 0.652 . . . . 0.0 110.755 -176.491 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.586 ' CD2' ' CE1' ' A' 1017 ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.313 -1.018 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.285 -172.476 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.573 ' NE2' ' HD2' ' A' 1017 ' ' TYR . 8.8 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.725 0.774 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' A' 1018 ' ' LYS . 0.7 OUTLIER -65.54 -41.08 93.42 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.875 -179.473 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -50.22 -52.13 38.53 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.698 173.138 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.855 ' HB3' HD22 ' A' 1004 ' ' LEU . 0.9 OUTLIER -73.96 -19.44 60.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.343 0.592 . . . . 0.0 110.595 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.437 ' HB3' ' O ' ' A' 1015 ' ' GLN . 23.1 tptm -71.34 -46.06 61.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.89 171.179 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -58.05 -56.42 22.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.159 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -47.94 -41.32 24.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.825 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.538 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 2.6 ptp -77.27 -23.34 51.2 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.998 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 67.3 tp -69.05 -39.76 78.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.143 0.497 . . . . 0.0 109.944 179.064 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 20.7 m -64.97 -33.75 76.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.05 175.362 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.34 -26.78 46.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.386 177.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.83 -37.08 73.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.193 177.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.487 ' O ' HG21 ' A' 1030 ' ' VAL . 20.3 t60 -66.6 -42.91 86.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.63 175.627 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.65 -51.2 68.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.115 178.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.594 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -64.75 -33.71 76.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.691 -179.089 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.581 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.06 -43.16 86.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.362 172.908 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' 1026 ' ' HIS . 96.0 t -67.35 -38.97 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 177.186 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.791 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 4.9 m-20 -61.24 -44.49 97.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.846 177.529 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.39 -57.04 12.82 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.964 0.412 . . . . 0.0 110.351 167.651 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' 1036 ' ' LEU . 84.9 mttt -66.22 -22.99 66.35 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -170.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.629 ' O ' HG23 ' A' 1038 ' ' VAL . 66.8 t30 -73.34 -41.15 63.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.776 175.697 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.732 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tm? -75.56 -26.12 57.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.605 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.901 HD22 ' HB ' ' A' ' 929' ' ' VAL . 3.1 tm? -54.35 -52.04 62.86 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.198 169.575 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 18.9 t70 -72.34 -36.17 68.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.646 -178.694 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.9 HG12 ' HB3' ' A' ' 983' ' ' GLU . 18.3 t -51.69 -60.8 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.333 174.373 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.737 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 29.1 pt -89.83 -24.48 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -171.711 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -53.63 -48.25 69.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 162.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.648 ' O ' ' HG2' ' A' 1045 ' ' LYS . 31.7 mt-30 -74.43 -21.65 59.51 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.248 176.366 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.737 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -52.94 -54.04 40.77 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 118.801 0.728 . . . . 0.0 110.625 171.567 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.708 ' HB3' ' HA ' ' A' ' 920' ' ' ARG . 3.3 mpt_? -53.17 -34.79 58.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 173.411 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.772 ' HB2' ' CD ' ' A' ' 920' ' ' ARG . 3.3 tm? -73.73 -34.13 64.64 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.296 173.82 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1045 ' ' LYS . . . . . 0.758 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.8 mmtt -55.81 -28.31 55.63 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.529 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.4 ttm -72.12 -46.76 55.38 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.185 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1047 ' ' ILE . . . . . 0.418 ' HB ' HD22 ' A' 1044 ' ' LEU . 41.0 mm -64.69 -41.85 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.821 175.358 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 20.6 t -52.73 -41.58 64.1 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.301 175.782 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 25.1 tm0? . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.357 -178.766 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.603 ' CG ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 16.7 m -59.05 141.13 54.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 166.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.75 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.32 82.02 0.15 Allowed 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 122.313 0.245 . . . . 0.0 111.422 -174.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 925' ' ' VAL . 3.3 t70 -46.23 -174.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 O-C-N 126.028 2.08 . . . . 0.0 113.055 -170.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.548 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.2 tmtp? -42.97 -19.38 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.281 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.887 ' HA ' HG22 ' A' ' 968' ' ' THR . 2.3 m -60.15 -56.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.867 174.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.446 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 57.3 t80 -78.67 -25.03 44.82 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.425 1.107 . . . . 0.0 108.508 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 98.3 mt-10 -63.6 -62.82 1.42 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.799 -1.546 . . . . 0.0 111.807 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.42 -32.94 66.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.196 -0.456 . . . . 0.0 112.188 -171.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.786 HG21 HD12 ' A' 1039 ' ' ILE . 19.0 m -60.65 -36.47 70.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.727 0.299 . . . . 0.0 111.512 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.646 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.5 m -61.45 -36.9 81.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 171.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.95 63.24 Favored Glycine 0 CA--C 1.522 0.504 0 CA-C-N 114.558 -1.201 . . . . 0.0 113.279 175.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 1.015 HD13 HD23 ' A' ' 965' ' ' LEU . 3.1 tt -63.86 -50.74 67.64 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.504 ' O ' HG22 ' A' ' 936' ' ' VAL . 39.4 t -58.51 -42.02 83.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.083 0.468 . . . . 0.0 110.316 178.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.646 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -63.19 -28.81 70.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.115 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.558 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.37 -25.45 42.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.466 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.539 ' HA ' HG11 ' A' ' 958' ' ' VAL . 0.9 OUTLIER -78.75 -14.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.227 173.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 70.3 mt -69.59 -35.31 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 168.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.558 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 13.7 mm-40 -54.59 -38.43 66.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.284 171.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.888 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 44.4 ttm -58.02 -43.36 86.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.144 0.497 . . . . 0.0 110.04 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.645 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 14.0 m -68.33 -39.95 81.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.043 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.51 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 17.2 p -76.93 -35.94 56.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -173.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 7.4 mmtp -54.78 -47.92 73.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.516 -1.22 . . . . 0.0 112.147 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.778 ' HB ' ' HE3' ' A' ' 954' ' ' MET . 10.8 tt -71.24 -24.37 24.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.435 -174.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.691 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 85.1 mt-30 -57.52 -57.88 22.14 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.691 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.9 Cg_endo -96.2 -16.31 0.38 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.46 1.44 . . . . 0.0 114.124 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.503 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -103.35 158.33 32.03 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -171.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.757 ' HG2' ' HG2' ' A' ' 949' ' ' GLU . 84.0 Cg_endo -92.31 -174.97 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 123.804 3.003 . . . . 0.0 113.155 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.628 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 81.7 Cg_exo -49.83 -31.64 27.05 Favored 'Trans proline' 0 C--N 1.363 1.291 0 C-N-CA 123.719 2.946 . . . . 0.0 114.885 -178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.757 ' HG2' ' HG2' ' A' ' 947' ' ' PRO . 11.7 pt-20 -55.48 -29.5 58.88 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.634 176.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.603 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 51.0 mm-40 -98.14 -5.54 33.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.604 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 1.023 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 2.8 m-85 -55.0 -46.08 75.12 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.002 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -70.1 -51.96 13.36 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 119.267 -0.973 . . . . 0.0 112.324 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.002 ' HD3' HG12 ' A' ' 952' ' ' VAL . 87.9 Cg_exo -53.04 -31.98 56.32 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.731 2.287 . . . . 0.0 115.158 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 1.023 ' HE2' ' HA ' ' A' ' 951' ' ' TYR . 20.7 ptp -64.8 -39.83 94.23 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.021 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.615 ' O ' HG22 ' A' ' 958' ' ' VAL . 65.7 t -67.12 -28.01 41.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.917 169.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.9 tptm -65.25 -33.82 76.89 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.6 mm-40 -56.31 -47.38 78.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.971 174.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 955' ' ' VAL . 3.2 m -70.36 -25.15 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.437 174.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.613 ' HA2' HD23 ' A' ' 995' ' ' LEU . . . -69.03 -45.81 61.28 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.083 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.413 ' O ' HD12 ' A' ' 960' ' ' LEU . 2.3 tm? -62.35 -30.49 71.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.961 0.41 . . . . 0.0 109.917 171.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.7 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -57.18 -57.01 14.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.072 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.909 ' HB2' HD13 ' A' ' 995' ' ' LEU . 2.9 tm? -60.55 -40.62 92.22 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.578 177.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -50.39 -56.59 10.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.555 0.693 . . . . 0.0 110.894 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.9 m -53.35 -40.51 64.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.238 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 1.015 HD23 HD13 ' A' ' 932' ' ' LEU . 6.3 mp -68.3 -27.22 66.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.523 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.8 tt -56.96 -36.13 69.94 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.53 97.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.284 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.887 HG22 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -62.23 -41.4 98.37 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.809 173.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.434 HG21 ' O ' ' A' ' 965' ' ' LEU . 87.9 t -55.11 -31.85 26.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.927 174.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.9 t70 -75.84 -34.09 60.08 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.129 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.572 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.8 mm-40 -59.73 -53.13 61.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.515 1.15 . . . . 0.0 108.762 172.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.47 ' OG ' HG22 ' A' ' 980' ' ' THR . 41.0 t -67.57 -22.3 65.4 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.756 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.697 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 28.7 tp -53.3 -55.62 32.57 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 118.579 -0.725 . . . . 0.0 112.144 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 35.4 Cg_exo -63.8 -23.8 68.8 Favored 'Trans proline' 0 C--N 1.358 1.069 0 CA-C-N 121.127 1.438 . . . . 0.0 111.02 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.53 HG12 ' HB2' ' A' 1046 ' ' MET . 11.5 t -77.51 -8.62 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.162 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 1.4 pp -83.47 -40.14 0.77 Allowed Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.363 -0.836 . . . . 0.0 111.951 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.58 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 18.3 Cg_endo -63.99 -23.91 67.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 120.797 1.321 . . . . 0.0 110.133 168.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.448 ' HB2' ' O ' ' A' ' 975' ' ' VAL . . . -64.87 -62.68 1.42 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.148 169.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.82 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.4 m -165.76 -32.31 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.648 HG23 ' HB ' ' A' ' 984' ' ' ILE . 3.4 m -57.27 -18.22 15.47 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.601 ' HA ' HG21 ' A' ' 984' ' ' ILE . 15.0 p-80 -48.71 -20.75 0.5 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -174.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -70.97 -57.41 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.486 177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.959 ' HG2' HG21 ' A' 1038 ' ' VAL . 0.0 OUTLIER -82.91 -34.5 26.61 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -178.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.648 ' HB ' HG23 ' A' ' 980' ' ' THR . 10.2 tp -61.76 -24.48 34.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -74.78 -48.98 22.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 168.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.752 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 10.6 ptp -63.84 -44.81 92.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.781 -171.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.791 ' HB3' HG23 ' A' 1038 ' ' VAL . . . -78.71 -46.01 19.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 1.055 ' HA ' HD13 ' A' ' 991' ' ' LEU . 22.8 tm0? -62.87 -43.77 97.91 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.87 -175.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 54.3 mttp -62.33 -33.9 75.59 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.341 0.591 . . . . 0.0 109.7 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.541 ' HG ' ' CB ' ' A' 1031 ' ' ASP . 3.6 tp -71.49 -38.82 71.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.744 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.055 HD13 ' HA ' ' A' ' 988' ' ' GLN . 5.6 mt -61.79 -51.59 67.66 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.493 0.663 . . . . 0.0 109.451 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.425 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 33.0 t30 -55.49 -45.12 77.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.065 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.647 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 50.0 m -64.64 -48.44 74.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.168 -177.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.34 -40.13 8.06 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -167.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.909 HD13 ' HB2' ' A' ' 962' ' ' LEU . 3.5 tt -60.99 -41.14 95.9 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.723 175.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.425 ' HB1' ' O ' ' A' ' 992' ' ' ASN . . . -61.43 -42.57 98.95 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 175.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.647 ' HG2' ' O ' ' A' ' 993' ' ' SER . 68.4 mm-40 -52.39 -48.35 65.69 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.088 175.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.526 ' O ' HG11 ' A' ' 955' ' ' VAL . 4.0 mm? -58.55 -37.26 75.32 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 110.191 -175.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.04 -44.43 87.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.195 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.693 ' O ' ' HB2' ' A' 1004 ' ' LEU . 16.6 m-80 -93.81 -11.17 31.86 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.483 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' 1001 ' ' LYS . 36.1 mmtm -85.97 -40.66 15.61 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.281 -0.168 . . . . 0.0 111.316 -176.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.812 ' HE2' ' HE3' ' A' 1021 ' ' MET . 42.5 tpp -77.44 -36.5 53.01 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 172.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.813 ' O ' ' HB2' ' A' 1007 ' ' GLN . 63.0 tttp -53.87 -53.4 53.05 Favored 'General case' 0 C--O 1.211 -0.939 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 171.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.7 tt -53.06 -52.2 59.31 Favored 'General case' 0 C--O 1.22 -0.482 0 O-C-N 123.932 0.77 . . . . 0.0 111.336 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.483 ' O ' ' HD2' ' A' 1017 ' ' TYR . . . -55.76 -52.22 64.7 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.09 0.472 . . . . 0.0 109.939 -178.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.578 ' NE2' ' HB3' ' A' ' 948' ' ' PRO . 7.4 mm100 -72.74 -9.83 59.09 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.626 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.813 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.8 tp-100 -95.34 -27.44 15.46 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.399 0.619 . . . . 0.0 110.823 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 23.4 t80 -94.04 -2.07 53.5 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.476 ' HA ' ' OE1' ' A' 1014 ' ' GLN . 5.4 p -28.95 115.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 113.73 -1.577 . . . . 0.0 114.285 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.5 ttt -99.25 -82.55 0.44 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.996 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 91.7 m -155.83 -82.07 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 172.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 20.2 m -90.29 -16.95 28.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.46 0.648 . . . . 0.0 109.808 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.634 ' O ' ' HB3' ' A' 1016 ' ' GLU . 17.2 tp -74.0 -5.78 43.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.939 176.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.476 ' OE1' ' HA ' ' A' 1009 ' ' VAL . 8.7 tp60 -57.31 -41.19 79.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.452 0.644 . . . . 0.0 110.429 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' 1019 ' ' LYS . 12.4 pt20 -70.22 -26.6 63.94 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.918 -177.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.634 ' HB3' ' O ' ' A' 1013 ' ' LEU . 2.7 tp10 -53.74 -53.82 46.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.586 0.231 . . . . 0.0 110.875 166.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.483 ' HD2' ' O ' ' A' 1005 ' ' ALA . 0.4 OUTLIER -64.1 -25.16 67.98 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.609 ' HE2' ' HE1' ' A' 1002 ' ' MET . 28.8 tptp -74.42 -25.29 59.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.389 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' 1015 ' ' GLN . 34.7 mmtp -68.55 -57.67 5.43 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -50.26 -35.08 25.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.323 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.812 ' HE3' ' HE2' ' A' 1002 ' ' MET . 1.7 tmt? -66.4 -43.58 85.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.765 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 41.3 tp -64.49 -39.25 93.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.756 0.312 . . . . 0.0 110.954 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 41.1 m -63.05 -32.88 74.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.596 0.713 . . . . 0.0 110.335 175.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.503 ' O ' HD23 ' A' ' 998' ' ' LEU . . . -78.12 -39.77 40.23 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.812 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.4 -35.18 75.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.78 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.558 ' O ' HG21 ' A' 1030 ' ' VAL . 11.2 t-80 -62.97 -39.2 93.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.898 174.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.8 82.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.52 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.778 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.94 -34.28 71.32 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.317 0.579 . . . . 0.0 110.296 179.297 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.626 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.59 -32.78 65.56 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.629 -0.67 . . . . 0.0 110.666 171.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.558 HG21 ' O ' ' A' 1026 ' ' HIS . 99.3 t -71.7 -27.99 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.68 175.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.541 ' CB ' ' HG ' ' A' ' 990' ' ' LEU . 2.5 p30 -74.27 -40.92 62.01 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.632 -0.827 . . . . 0.0 109.478 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -60.28 -49.65 76.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.679 ' O ' ' HG ' ' A' 1036 ' ' LEU . 54.1 tptt -59.97 -49.48 77.53 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.787 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.697 ' O ' HG22 ' A' 1038 ' ' VAL . 65.9 t30 -62.76 -43.61 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.378 -176.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.848 HD23 HD12 ' A' ' 991' ' ' LEU . 19.1 tp -72.82 -38.08 67.29 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.031 -175.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.733 ' HA ' HD12 ' A' 1039 ' ' ILE . 3.5 pp -61.0 -19.55 61.45 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 120.688 0.28 . . . . 0.0 110.586 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -98.52 -33.96 10.79 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.959 HG21 ' HG2' ' A' ' 983' ' ' GLU . 19.9 t -53.11 -58.9 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.875 172.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.807 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -83.19 -24.32 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.749 -177.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.79 ' H ' HD13 ' A' 1039 ' ' ILE . 8.6 t70 -58.12 -42.21 85.26 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 163.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.554 ' O ' ' HG2' ' A' 1045 ' ' LYS . 36.5 mt-30 -68.29 -34.73 76.7 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.888 172.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.718 ' HA ' ' HG2' ' A' 1045 ' ' LYS . . . -52.39 -51.61 58.1 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.891 0.377 . . . . 0.0 110.952 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.75 ' HG3' ' HA ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER -47.28 -41.48 18.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.378 172.102 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.7 ' N ' ' HD3' ' A' 1043 ' ' ARG . 28.0 tp -80.37 -26.64 38.51 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.966 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.82 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.0 mmmt -64.32 -39.94 94.92 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.53 ' HB2' HG12 ' A' ' 975' ' ' VAL . 13.7 tmm? -63.2 -43.32 98.48 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.705 176.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.56 ' O ' ' HB2' ' A' 1051 ' ' ARG . 41.8 mm -62.71 -44.17 99.25 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 173.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.6 m -47.83 -45.17 29.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.596 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -86.98 -56.81 3.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.883 0.373 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 19.3 t -94.89 32.07 1.73 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.726 -168.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.56 ' HB2' ' O ' ' A' 1047 ' ' ILE . 45.8 ttp180 -64.5 124.07 84.85 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -44.44 -64.26 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.618 2.879 . . . . 0.0 113.479 -174.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 61.3 m80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.351 -0.833 . . . . 0.0 109.798 178.497 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 4.9 tpp180 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.4 m -86.37 50.56 2.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.489 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER 42.3 52.45 4.58 Favored 'General case' 0 CA--C 1.498 -1.051 0 C-N-CA 123.494 0.717 . . . . 0.0 111.728 176.1 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.9 t70 -46.77 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 O-C-N 125.694 1.871 . . . . 0.0 112.742 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.712 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.5 tmtp? -36.4 -21.16 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 124.212 1.005 . . . . 0.0 112.519 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.77 ' HA ' HG21 ' A' ' 968' ' ' THR . 19.2 m -60.49 -53.84 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 C-N-CA 123.284 0.634 . . . . 0.0 112.364 175.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.415 ' N ' HG23 ' A' ' 925' ' ' VAL . 38.5 t80 -79.77 -37.37 35.5 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 122.084 0.945 . . . . 0.0 108.908 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.432 ' O ' ' HB ' ' A' ' 930' ' ' THR . 45.7 mt-10 -58.37 -54.84 42.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.703 -178.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.712 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 65.6 t30 -73.68 -33.01 64.24 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -172.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.626 HG12 ' N ' ' A' 1036 ' ' LEU . 21.3 t -63.06 -32.97 58.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.567 172.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.631 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.8 m -61.31 -35.83 78.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 170.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.87 -31.97 69.27 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.18 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.894 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.5 tt -64.12 -38.4 90.92 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 937' ' ' ILE . 22.0 t -69.4 -41.49 80.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.933 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -58.67 -35.29 72.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.177 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.772 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.38 -24.78 42.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.788 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.555 HG12 ' HA ' ' A' ' 933' ' ' VAL . 9.1 p -83.12 -15.39 11.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.406 171.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -68.94 -37.72 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 165.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.744 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.0 mm-40 -52.48 -36.88 55.95 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.744 169.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.538 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.3 tmm? -60.99 -41.92 97.4 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 50.2 m -73.82 -31.26 63.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.735 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 938' ' ' GLU . 22.9 p -77.05 -43.35 34.79 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.686 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.3 mmtp -52.76 -53.24 50.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.187 174.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.838 HG13 ' HE1' ' A' ' 951' ' ' TYR . 14.2 tt -63.58 -23.62 33.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.765 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 73.7 mt-30 -55.39 -62.79 3.84 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.319 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.765 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 44.4 Cg_endo -97.31 25.47 0.24 Allowed 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 121.631 1.554 . . . . 0.0 114.028 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.93 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -113.58 138.8 22.73 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.685 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 69.0 Cg_endo -88.38 -174.07 1.03 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 123.611 2.874 . . . . 0.0 109.972 165.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.782 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 8.1 Cg_endo -51.87 -31.92 44.84 Favored 'Trans proline' 0 C--O 1.247 0.935 0 C-N-CA 122.4 2.067 . . . . 0.0 112.361 176.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.418 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 48.1 mt-10 -52.75 -38.56 61.12 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.775 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.93 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 44.2 mt-10 -104.49 6.42 34.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.838 ' HE1' HG13 ' A' ' 943' ' ' ILE . 5.4 m-30 -66.5 -38.3 86.93 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 170.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.051 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -75.87 -47.72 3.79 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.211 174.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.051 ' HD3' HG12 ' A' ' 952' ' ' VAL . 89.2 Cg_exo -55.28 -26.5 52.5 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.719 1.612 . . . . 0.0 114.943 172.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.622 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 16.8 ptp -73.37 -36.01 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.596 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.964 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -64.08 -27.47 42.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.424 169.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 20.7 ttmm -58.49 -38.45 77.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 175.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.406 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 4.9 mm-40 -57.87 -48.18 80.58 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.271 178.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 6.1 m -73.3 -22.61 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 O-C-N 122.205 -0.31 . . . . 0.0 111.198 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.46 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.29 -44.42 34.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.224 -0.989 . . . . 0.0 111.459 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.28 -26.83 68.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.389 171.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.894 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.28 -54.4 37.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 174.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.589 HD23 HD12 ' A' ' 965' ' ' LEU . 3.4 tm? -62.09 -37.15 83.97 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.401 ' HA ' ' HD3' ' A' ' 963' ' ' ARG . 34.1 mmt180 -56.25 -60.22 3.81 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 172.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 2.1 p -52.79 -40.76 63.5 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.194 0.521 . . . . 0.0 110.211 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.589 HD12 HD23 ' A' ' 962' ' ' LEU . 2.7 tm? -57.05 -35.29 69.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.026 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.441 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 48.6 tp -64.64 -29.04 70.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -178.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.58 96.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.178 0.513 . . . . 0.0 110.097 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.77 HG21 ' HA ' ' A' ' 925' ' ' VAL . 4.5 m -64.24 -35.97 82.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.628 173.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.736 HG12 HD13 ' A' ' 984' ' ' ILE . 83.1 t -54.95 -31.09 24.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.726 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.502 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -74.87 -28.3 60.6 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 120.528 0.204 . . . . 0.0 111.485 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.612 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 23.8 mm-40 -64.79 -53.99 38.25 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 123.027 1.394 . . . . 0.0 108.543 172.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.445 ' HB3' HG23 ' A' 1039 ' ' ILE . 10.4 p -67.24 -22.15 65.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.888 -1.505 . . . . 0.0 111.301 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.699 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 44.6 tp -54.34 -54.67 45.49 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-O 118.938 -0.553 . . . . 0.0 112.127 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.699 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 31.3 Cg_exo -62.39 -25.39 76.22 Favored 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 121.3 1.333 . . . . 0.0 110.941 171.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.55 HG13 ' HB ' ' A' ' 980' ' ' THR . 49.4 t -73.6 -12.88 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.567 174.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.764 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 4.9 tt -74.46 -53.96 3.29 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.557 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.3 Cg_exo -62.36 -22.26 73.84 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.111 1.207 . . . . 0.0 110.693 173.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.527 ' HA ' ' HG3' ' A' 1049 ' ' GLN . . . -70.35 -65.13 0.77 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.101 173.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.753 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.1 m -161.38 -32.76 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.788 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -172.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.66 HG22 ' HA ' ' A' ' 976' ' ' LEU . 1.4 t -66.27 -13.82 61.02 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -173.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.764 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 42.4 t60 -49.83 -21.82 1.26 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.879 0.471 . . . . 0.0 112.097 -174.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.605 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 6.1 ptp180 -78.68 -53.43 7.16 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.024 0.44 . . . . 0.0 110.634 176.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.821 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.2 OUTLIER -77.48 -46.27 23.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -175.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.736 HD13 HG12 ' A' ' 969' ' ' VAL . 11.8 tt -55.45 -34.56 34.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.119 0.485 . . . . 0.0 110.112 -174.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -72.94 -34.26 66.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.305 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 23.1 ptm -66.22 -58.04 6.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.332 -0.547 . . . . 0.0 112.006 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.601 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.42 -36.29 33.91 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.404 ' NE2' HG21 ' A' ' 969' ' ' VAL . 6.5 tp60 -67.15 -36.25 81.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.774 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.723 ' HZ2' ' HB2' ' A' ' 989' ' ' LYS . 4.8 ttmp? -66.86 -31.41 71.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.596 0.712 . . . . 0.0 109.123 174.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.45 -39.44 70.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.628 178.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.785 ' HA ' ' OD1' ' A' ' 994' ' ' ASP . 47.3 mt -74.03 -29.12 61.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.299 -176.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -60.95 -43.62 98.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 15.5 m -77.65 -33.85 53.34 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.804 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.785 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p-10 -91.37 -38.07 12.83 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.853 -0.529 . . . . 0.0 111.247 -170.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.513 ' HA ' ' CD1' ' A' 1028 ' ' LEU . 2.7 tm? -59.01 -37.13 76.2 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.562 ' O ' HG22 ' A' ' 999' ' ' ILE . . . -59.93 -51.85 67.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.224 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.645 ' O ' ' HG2' ' A' 1001 ' ' LYS . 2.8 pt-20 -63.7 -35.23 79.88 Favored 'General case' 0 C--O 1.215 -0.731 0 C-N-CA 118.688 -1.205 . . . . 0.0 110.105 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.723 HD13 ' HE3' ' A' 1002 ' ' MET . 1.8 mm? -69.43 -42.34 75.14 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.689 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.801 ' HA ' HG12 ' A' ' 955' ' ' VAL . 17.4 tt -59.65 -25.36 31.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.009 0.433 . . . . 0.0 110.804 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.658 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.0 OUTLIER -104.03 -7.71 20.1 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.987 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.645 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 31.0 mmtp -83.48 -37.69 22.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.964 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 18.9 mmt -72.91 -41.97 64.04 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.8 ttpt -58.13 -48.71 79.38 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 114.275 -1.33 . . . . 0.0 109.639 172.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' 1000 ' ' ASN . 45.7 tp -58.5 -45.74 88.14 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.627 ' HB3' HE22 ' A' 1014 ' ' GLN . . . -63.77 -49.3 73.5 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.372 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.2 pp0? -67.24 -17.64 64.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.901 176.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.729 ' HB2' ' O ' ' A' 1003 ' ' LYS . 6.2 tp-100 -77.77 -33.64 52.65 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.6 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.545 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 17.4 t80 -74.04 -76.87 0.12 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.393 -179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.422 HG23 HD12 ' A' 1013 ' ' LEU . 7.5 p 32.33 77.08 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 124.321 1.013 . . . . 0.0 112.438 -177.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' 1008 ' ' TYR . 68.2 mtt -139.6 -103.71 0.16 Allowed 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.804 -178.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 13.1 m -84.21 132.09 34.69 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 23.9 p 42.42 59.69 2.61 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -162.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.422 HD12 HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -44.78 -58.09 3.31 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.676 -149.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.763 ' HG3' ' HE2' ' A' ' 951' ' ' TYR . 0.6 OUTLIER -88.46 -42.93 11.81 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.547 ' O ' ' HG3' ' A' 1019 ' ' LYS . 45.0 mt-30 -59.8 -48.28 82.3 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -156.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -50.88 -52.13 44.83 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 111.309 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.545 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.09 -24.72 61.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.849 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.663 ' HA ' ' HB3' ' A' 1021 ' ' MET . 24.3 tttt -67.92 -31.28 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.655 0.264 . . . . 0.0 110.52 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' 1015 ' ' GLN . 84.1 mttt -61.45 -57.67 11.28 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -50.58 -45.44 57.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.999 172.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.663 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 6.4 ttt -56.41 -54.05 50.14 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.527 0.731 . . . . 0.0 112.0 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.93 -45.22 90.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.644 -175.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 17.0 m -61.22 -32.42 72.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.332 0.587 . . . . 0.0 110.612 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.488 ' O ' HD23 ' A' ' 998' ' ' LEU . . . -78.23 -43.56 28.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.98 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.534 ' CA ' HD12 ' A' ' 998' ' ' LEU . . . -59.1 -31.48 68.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.927 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -70.0 -38.44 75.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.435 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -59.95 -44.11 94.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 174.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.709 ' HA ' ' OD2' ' A' ' 994' ' ' ASP . 1.9 tt -61.76 -54.86 36.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.58 0.705 . . . . 0.0 110.427 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.547 ' HB1' HG21 ' A' ' 936' ' ' VAL . . . -56.49 -36.83 69.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.949 -176.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1030 ' ' VAL . . . . . . . . . . . . . 70.4 t -75.2 -41.68 44.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.808 0.337 . . . . 0.0 110.602 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.461 ' O ' HD21 ' A' ' 991' ' ' LEU . 43.6 m-20 -67.05 -30.0 69.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.537 ' HB3' HD23 ' A' ' 932' ' ' LEU . . . -52.23 -50.91 61.05 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 164.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.513 ' O ' ' HB3' ' A' 1036 ' ' LEU . 58.1 mtmt -64.22 -17.41 63.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.596 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.482 ' O ' HG21 ' A' 1038 ' ' VAL . 59.5 t30 -75.38 -37.3 60.65 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.013 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.686 ' O ' HG13 ' A' 1039 ' ' ILE . 33.3 tp -75.27 -20.44 59.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.626 ' N ' HG12 ' A' ' 929' ' ' VAL . 45.9 tp -57.75 -51.09 71.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.28 174.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -31.46 67.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.728 178.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.821 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 18.6 t -60.69 -62.45 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.005 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.686 HG13 ' O ' ' A' 1035 ' ' LEU . 1.8 mt -77.6 -24.8 14.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.343 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' 1043 ' ' ARG . 18.0 t70 -61.81 -37.88 86.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.798 165.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.703 ' O ' ' HG2' ' A' 1045 ' ' LYS . 13.3 mm100 -70.74 -32.33 69.46 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.076 171.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.542 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.81 -45.3 74.36 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 121.353 0.597 . . . . 0.0 110.081 171.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.58 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.09 -50.19 15.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.127 170.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.508 ' N ' ' HD3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -79.64 -20.88 45.68 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.374 -0.204 . . . . 0.0 111.416 178.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.753 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 38.0 mmtm -65.22 -40.4 94.03 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.67 -44.45 96.45 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.946 -1.024 . . . . 0.0 109.412 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.404 ' HB ' HD21 ' A' 1044 ' ' LEU . 43.8 mm -64.59 -48.22 85.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.442 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -35.28 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.125 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.527 ' HG3' ' HA ' ' A' ' 978' ' ' ALA . 1.1 tm0? -79.19 -50.1 11.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 20.1 m -64.78 -47.06 79.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.118 -177.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -173.39 98.24 0.33 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.46 -71.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.189 1.926 . . . . 0.0 112.366 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 42.9 m80 . . . . . 0 C--O 1.245 0.866 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.046 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.794 ' HA ' ' HE ' ' A' ' 920' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.734 0.302 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -82.49 47.48 1.17 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.564 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.453 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 46.84 72.03 0.27 Allowed 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.951 0.9 . . . . 0.0 113.035 174.53 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.92 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 1.9 t70 -45.44 -175.5 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 O-C-N 125.624 1.828 . . . . 0.0 112.873 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.1 tmtp? -42.56 -22.66 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.388 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.834 ' HA ' HG21 ' A' ' 968' ' ' THR . 15.5 m -56.64 -51.61 63.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.27 174.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.423 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 5.0 t80 -77.61 -34.43 53.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.179 -1.008 . . . . 0.0 109.348 -175.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -61.68 -49.25 77.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.418 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.431 HD21 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.5 -38.21 77.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.539 -176.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 1.019 ' HA ' HD12 ' A' ' 932' ' ' LEU . 2.9 t -66.0 -29.67 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.846 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.597 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 38.6 m -61.67 -40.28 94.41 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.08 -27.63 60.16 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 114.568 -1.197 . . . . 0.0 113.351 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 1.073 HD13 ' HB2' ' A' ' 965' ' ' LEU . 10.0 mp -64.13 -41.88 97.05 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 117.86 0.83 . . . . 0.0 109.745 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.581 ' O ' HG22 ' A' ' 937' ' ' ILE . 77.9 t -70.59 -35.38 61.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.307 0.575 . . . . 0.0 109.909 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.597 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.2 mmpt? -67.12 -19.14 65.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.168 0.509 . . . . 0.0 109.971 174.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.625 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -83.0 -26.54 31.14 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.653 175.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.54 HG11 ' HA ' ' A' ' 933' ' ' VAL . 8.5 p -88.13 -15.09 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 120.131 -0.627 . . . . 0.0 110.274 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.581 HG22 ' O ' ' A' ' 933' ' ' VAL . 21.0 pt -75.38 -31.84 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 167.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.625 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.9 mm-40 -56.22 -44.84 79.92 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.873 166.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.722 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 26.1 ttt -59.16 -38.98 81.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.726 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.552 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.6 m -67.82 -40.94 83.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.826 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.4 t -76.05 -41.46 50.62 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -175.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.604 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 10.1 mmtm -47.31 -54.03 12.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.876 176.168 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.616 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 13.6 tt -71.23 -21.51 21.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.548 -174.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.791 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.3 mm-40 -54.74 -63.02 3.24 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 93.4 Cg_endo -98.69 -5.64 0.75 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.699 1.599 . . . . 0.0 114.178 -176.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -111.7 151.63 43.53 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.491 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 90.3 Cg_endo -78.79 -176.61 3.37 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.563 2.842 . . . . 0.0 112.796 -176.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.73 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 75.3 Cg_exo -51.98 -25.75 23.03 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 123.133 2.555 . . . . 0.0 113.35 175.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.411 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 30.1 mm-40 -56.82 -30.7 63.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.829 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.701 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.9 mp0 -97.63 -1.05 44.56 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.641 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.73 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -57.48 -40.69 79.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 170.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.018 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.3 OUTLIER -74.98 -52.45 3.26 Favored Pre-proline 0 CA--C 1.554 1.133 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.115 177.112 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.999 ' HD3' HG12 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.72 -32.33 45.03 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.089 1.859 . . . . 0.0 115.031 172.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.722 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 27.3 ptt? -68.53 -44.54 74.38 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.921 -0.711 . . . . 0.0 110.227 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.678 ' HB ' ' HB3' ' A' 1002 ' ' MET . 70.2 t -66.23 -26.46 38.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.032 170.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 1.6 tmtp? -59.67 -36.99 77.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.2 mm-40 -55.96 -47.35 77.79 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.707 175.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.591 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 3.2 m -73.89 -22.06 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 120.762 0.315 . . . . 0.0 111.241 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.68 -43.47 59.87 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.022 175.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.1 tp -60.29 -23.14 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.345 -0.427 . . . . 0.0 110.512 171.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.848 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.99 -56.36 15.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.776 177.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.715 HD12 HD13 ' A' ' 991' ' ' LEU . 13.9 tp -62.59 -38.67 91.06 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.987 176.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 20.4 tpp180 -51.4 -62.64 1.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 0.0 111.68 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 20.5 p -56.2 -36.82 68.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.841 0.353 . . . . 0.0 110.927 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 1.073 ' HB2' HD13 ' A' ' 932' ' ' LEU . 31.0 tp -58.08 -34.0 69.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.083 176.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 1.096 ' HA ' HG22 ' A' ' 969' ' ' VAL . 4.1 tt -70.32 -24.08 62.95 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.726 -0.389 . . . . 0.0 111.154 -177.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.96 95.87 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 167.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.834 HG21 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -69.36 -42.04 75.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.077 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 1.096 HG22 ' HA ' ' A' ' 966' ' ' LEU . 32.9 m -62.44 -26.34 40.19 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.531 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 18.5 t70 -73.25 -22.9 60.3 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.541 173.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.643 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.6 mm-40 -74.49 -49.94 20.2 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-O 122.113 0.959 . . . . 0.0 109.296 169.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.636 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 93.6 p -63.9 -26.46 68.61 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.929 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 1.076 ' HA ' HD12 ' A' ' 976' ' ' LEU . 0.9 OUTLIER -59.44 -52.26 75.49 Favored Pre-proline 0 N--CA 1.472 0.647 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 52.6 Cg_exo -57.2 -26.02 67.53 Favored 'Trans proline' 0 C--N 1.354 0.859 0 CA-C-N 120.687 1.281 . . . . 0.0 110.392 170.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.755 HG11 ' HB2' ' A' 1046 ' ' MET . 1.8 t -78.79 -18.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.416 175.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 1.076 HD12 ' HA ' ' A' ' 973' ' ' LEU . 8.5 mp -52.66 -58.42 11.99 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 118.147 0.43 . . . . 0.0 110.265 172.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 64.4 Cg_exo -54.81 -38.33 92.11 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 121.839 1.693 . . . . 0.0 111.962 174.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.74 -50.18 74.08 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.111 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.593 ' CB ' ' HG3' ' A' 1045 ' ' LYS . 31.1 t 179.63 -26.43 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.871 0.367 . . . . 0.0 111.287 -179.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.727 ' HG1' ' HB2' ' A' 1042 ' ' ALA . 89.9 m -51.56 -21.0 2.2 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -177.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -52.86 -20.13 3.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.675 0.274 . . . . 0.0 111.358 -177.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -76.83 -51.66 10.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.949 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.904 ' HB2' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -65.7 -54.86 21.62 Favored 'General case' 0 CA--C 1.494 -1.205 0 CA-C-O 122.063 0.935 . . . . 0.0 112.142 178.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.947 HG23 ' HG ' ' A' ' 976' ' ' LEU . 9.2 tp -63.73 -34.15 66.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 113.713 -1.585 . . . . 0.0 110.097 -164.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -60.1 -45.39 93.13 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.966 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.528 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 24.5 ptm -73.61 -52.94 11.69 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.201 -175.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.677 ' HB2' HD23 ' A' 1035 ' ' LEU . . . -78.65 -44.94 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -172.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.688 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.0 OUTLIER -63.44 -44.09 95.54 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.068 -0.253 . . . . 0.0 111.148 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -67.46 -31.92 72.41 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.482 0.658 . . . . 0.0 109.655 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.419 ' HB3' ' O ' ' A' ' 986' ' ' MET . 0.3 OUTLIER -64.52 -50.86 65.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.465 175.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.715 HD13 HD12 ' A' ' 962' ' ' LEU . 3.5 pp -74.2 -27.35 60.76 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.609 -175.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.535 ' N ' HD12 ' A' ' 991' ' ' LEU . 54.6 t30 -58.17 -42.1 85.29 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.438 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 13.5 m -77.82 -28.36 50.23 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.947 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.26 -43.18 8.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -172.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.957 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.88 -44.46 70.47 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 169.336 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.618 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -53.86 -45.76 71.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.258 177.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.696 ' O ' ' HG2' ' A' 1001 ' ' LYS . 22.1 mm-40 -61.36 -34.79 75.88 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 121.676 -0.64 . . . . 0.0 111.675 178.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.657 ' HG ' HD11 ' A' 1028 ' ' LEU . 2.4 mm? -69.31 -34.76 75.16 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.02 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.618 HG12 ' O ' ' A' ' 996' ' ' ALA . 19.9 pt -73.68 -13.36 15.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.938 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.621 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 4.8 p30 -104.15 -3.77 23.99 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.696 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 42.2 mmtm -85.71 -30.61 23.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 170.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.018 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 25.0 ptt? -72.92 -38.1 66.97 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 171.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.779 ' O ' ' HB2' ' A' 1007 ' ' GLN . 17.7 tppt? -63.02 -53.87 47.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.923 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.573 HD11 ' HD3' ' A' 1001 ' ' LYS . 17.1 mt -56.13 -46.81 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.462 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.44 -46.97 88.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.626 0.727 . . . . 0.0 110.373 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.92 -10.36 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.627 0.727 . . . . 0.0 110.03 178.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.779 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -88.74 -27.14 21.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.418 -179.151 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.65 19.62 12.52 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.58 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.537 ' HA ' ' HG2' ' A' 1014 ' ' GLN . 4.2 p -46.17 97.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.795 -1.093 . . . . 0.0 112.693 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.637 ' O ' ' HB2' ' A' 1014 ' ' GLN . 11.2 tpt -146.15 134.36 21.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.108 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 27.0 p -42.46 -48.51 5.23 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.0 m -112.22 -24.34 9.89 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.722 -0.391 . . . . 0.0 112.052 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -82.4 -22.4 35.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.637 ' HB2' ' O ' ' A' 1010 ' ' MET . 0.0 OUTLIER -54.62 -32.13 58.37 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.895 0.379 . . . . 0.0 110.979 -176.379 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.624 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 3.9 pt20 -54.86 -35.26 63.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.064 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.415 ' HA ' ' HE2' ' A' 1019 ' ' LYS . 37.7 tt0 -51.39 -52.56 44.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.826 0.346 . . . . 0.0 111.311 172.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.51 ' CE2' HD22 ' A' 1004 ' ' LEU . 3.2 m-85 -74.99 -21.24 59.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.976 0.417 . . . . 0.0 110.67 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.624 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 81.5 tttt -66.79 -47.0 73.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.452 176.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.415 ' HE2' ' HA ' ' A' 1016 ' ' GLU . 65.6 pttt -73.65 -19.53 60.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.047 0.451 . . . . 0.0 110.719 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.31 -33.3 37.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.54 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 43.5 ttp -71.66 -39.89 70.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.27 174.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.84 -48.86 72.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.151 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -62.17 -33.29 74.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.406 0.622 . . . . 0.0 110.65 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -76.07 -36.2 59.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.884 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.55 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -61.48 -36.5 80.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.493 178.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' 1030 ' ' VAL . 60.2 t60 -63.3 -35.83 81.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.885 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.59 68.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.335 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.957 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.61 -30.66 67.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.281 0.563 . . . . 0.0 110.276 178.003 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.495 ' N ' HD23 ' A' 1028 ' ' LEU . . . -55.84 -40.23 72.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 170.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' 1026 ' ' HIS . 75.1 t -66.95 -33.47 63.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.035 175.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.53 ' HB2' ' HA ' ' A' ' 991' ' ' LEU . 1.2 p30 -70.73 -41.95 71.2 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.295 -177.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.8 66.84 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 171.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 60.1 tttp -59.52 -39.84 85.18 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.737 ' O ' HG22 ' A' 1038 ' ' VAL . 7.5 t30 -68.43 -49.11 62.31 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 121.05 0.453 . . . . 0.0 110.282 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.677 HD23 ' HB2' ' A' ' 987' ' ' ALA . 3.3 tm? -67.54 -36.36 80.84 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.428 ' N ' HG12 ' A' ' 929' ' ' VAL . 5.2 tt -49.19 -44.11 42.79 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.321 0.649 . . . . 0.0 111.812 175.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' 1040 ' ' ASP . 24.3 t70 -89.0 -41.57 12.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.85 -176.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.904 HG12 ' HB2' ' A' ' 983' ' ' GLU . 3.3 t -74.26 -29.42 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.565 ' HA ' ' OE1' ' A' ' 983' ' ' GLU . 1.5 tt -81.14 -31.32 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.401 0.68 . . . . 0.0 110.302 170.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.48 ' HB3' ' O ' ' A' 1037 ' ' ASP . 35.3 t0 -52.78 -38.9 61.75 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 161.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' 1038 ' ' VAL . 48.0 mt-30 -76.27 -25.38 54.87 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.887 174.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.733 ' HB3' ' OE1' ' A' ' 983' ' ' GLU . . . -52.42 -56.31 15.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.709 1.141 . . . . 0.0 110.428 168.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.92 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 2.7 tpt180 -60.66 -29.77 69.48 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.464 178.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.413 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.5 tp -78.46 -25.36 45.84 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.37 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.593 ' HG3' ' CB ' ' A' ' 979' ' ' SER . 3.4 mptp? -62.23 -35.98 80.59 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.886 0.875 . . . . 0.0 109.504 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.755 ' HB2' HG11 ' A' ' 975' ' ' VAL . 1.7 tmt? -69.48 -42.31 74.98 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.223 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.464 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.9 mm -60.62 -31.75 49.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.719 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.537 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.8 m -64.79 -28.59 69.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.119 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -82.71 -31.48 28.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.947 0.403 . . . . 0.0 110.469 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.5 t -82.81 -17.88 42.47 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.84 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.664 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 66.7 ttt180 -56.45 -55.95 37.09 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.608 -175.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 1.3 Cg_endo -83.46 14.81 2.27 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.275 1.983 . . . . 0.0 113.509 -176.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 79.8 t60 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.568 -177.791 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.79 ' HD2' ' HB2' ' A' 1044 ' ' LEU . 15.0 ttt180 . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 121.089 0.471 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 3.0 t -111.31 29.27 7.96 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.444 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 48.27 59.45 4.28 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.738 -175.422 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.0 t70 -47.33 -173.54 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 O-C-N 125.631 1.832 . . . . 0.0 112.363 -176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.509 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.3 tmtp? -37.78 -25.05 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.374 1.07 . . . . 0.0 112.067 -177.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.731 ' HB ' HG13 ' A' 1039 ' ' ILE . 10.3 m -59.9 -49.79 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.059 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.63 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 62.2 t80 -75.93 -40.3 54.42 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.208 -178.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.96 -47.88 84.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.225 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.509 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.4 t-20 -72.18 -42.93 65.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.786 -173.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.647 ' CG2' HD11 ' A' 1039 ' ' ILE . 47.1 t -65.02 -30.17 49.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.676 178.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 51.8 m -60.85 -32.53 71.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.87 74.18 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.323 -1.308 . . . . 0.0 113.264 173.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.849 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.1 tt -61.78 -44.05 97.63 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 118.42 1.11 . . . . 0.0 108.314 175.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.567 ' O ' HG12 ' A' ' 937' ' ' ILE . 43.4 t -55.79 -44.1 76.26 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.549 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.1 mmpt? -61.58 -38.21 86.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' ' 961' ' ' ALA . . . -80.55 -25.58 38.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.893 -177.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.576 ' HA ' HG21 ' A' ' 958' ' ' VAL . 14.1 p -80.28 -15.58 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 C-N-CA 119.726 -0.789 . . . . 0.0 109.057 170.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 933' ' ' VAL . 20.5 mm -71.46 -35.37 56.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 166.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 70.4 mm-40 -52.85 -42.4 65.18 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.824 169.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.548 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 35.7 ttp -57.65 -46.69 83.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.485 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.4 p -72.75 -26.75 61.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.914 0.388 . . . . 0.0 110.979 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.488 ' HA ' ' NE2' ' A' ' 944' ' ' GLN . 20.2 m -78.82 -43.34 25.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.66 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.7 mmtp -54.58 -49.66 69.86 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.209 -1.814 . . . . 0.0 111.193 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.837 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.6 tt -65.57 -28.69 44.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 123.137 0.273 . . . . 0.0 111.599 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.758 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 69.1 mt-30 -50.06 -61.11 4.02 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.758 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 64.1 Cg_endo -97.78 16.73 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.562 1.508 . . . . 0.0 113.821 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.824 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -100.86 148.58 35.24 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -173.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.559 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 79.6 Cg_endo -86.4 -178.68 2.82 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.433 2.755 . . . . 0.0 110.231 165.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.861 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 10.0 Cg_endo -51.62 -34.63 53.78 Favored 'Trans proline' 0 C--O 1.249 1.057 0 C-N-CA 122.648 2.232 . . . . 0.0 112.73 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.507 ' O ' ' HD2' ' A' ' 953' ' ' PRO . 25.0 mt-10 -54.0 -39.05 65.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.018 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.824 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 1.3 mp0 -95.83 2.42 53.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.861 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 21.0 m-30 -65.7 -38.56 89.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 172.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.929 HG11 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.34 -55.47 6.05 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 119.536 -0.866 . . . . 0.0 111.511 174.117 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.929 ' HD3' HG11 ' A' ' 952' ' ' VAL . 75.2 Cg_exo -51.02 -32.07 37.29 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 122.124 1.883 . . . . 0.0 115.166 173.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.837 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.9 ptt? -65.93 -45.18 82.8 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 121.502 -0.749 . . . . 0.0 110.157 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.693 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.8 t -69.94 -25.52 28.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.202 0.525 . . . . 0.0 110.022 173.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.532 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 61.0 tttm -61.2 -37.93 84.75 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.7 mm-40 -54.23 -44.61 71.87 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.494 172.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.664 HG22 ' HA ' ' A' ' 955' ' ' VAL . 2.7 t -65.57 -28.64 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.497 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.543 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -71.72 -43.45 51.32 Favored Glycine 0 C--N 1.328 0.131 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.561 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.74 -32.28 73.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.849 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -54.3 -56.13 21.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.012 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.719 HD11 HD11 ' A' ' 991' ' ' LEU . 61.1 tp -66.53 -36.47 82.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -58.11 -49.68 76.11 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.741 -0.599 . . . . 0.0 110.71 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 26.8 m -53.69 -35.78 61.47 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.124 173.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.689 HD12 ' HB2' ' A' ' 932' ' ' LEU . 7.2 mt -66.02 -38.03 87.41 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 120.847 0.356 . . . . 0.0 110.134 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.17 -32.65 37.04 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.203 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.41 -47.63 63.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.467 HG21 ' O ' ' A' ' 965' ' ' LEU . 6.8 t -69.56 -32.35 71.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.314 0.578 . . . . 0.0 110.109 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.893 HG13 HD13 ' A' ' 984' ' ' ILE . 45.5 t -55.5 -32.5 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.126 169.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.713 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 27.6 t70 -71.08 -25.38 62.6 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 120.636 0.255 . . . . 0.0 110.875 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.445 ' O ' HG23 ' A' ' 975' ' ' VAL . 5.4 mm-40 -65.52 -49.69 68.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.984 1.373 . . . . 0.0 108.408 169.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.581 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.2 t -65.87 -24.28 66.83 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 113.834 -1.53 . . . . 0.0 111.766 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.703 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.2 OUTLIER -61.58 -53.21 63.61 Favored Pre-proline 0 C--O 1.215 -0.761 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.791 -176.496 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.713 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 6.9 Cg_endo -54.77 -28.44 57.48 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 121.497 1.57 . . . . 0.0 111.584 168.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.71 -11.59 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.881 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.904 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -67.58 -51.97 29.2 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-O 118.965 -0.541 . . . . 0.0 111.316 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.575 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 32.5 Cg_exo -60.83 -33.01 93.37 Favored 'Trans proline' 0 C--N 1.363 1.297 0 C-N-CA 121.503 1.468 . . . . 0.0 110.715 173.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -60.13 -54.89 40.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.873 175.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.813 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -168.74 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.765 HG22 ' HB ' ' A' ' 984' ' ' ILE . 17.4 m -52.46 -20.2 2.72 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -170.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.904 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 19.1 p-80 -49.66 -22.19 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -171.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.24 -54.78 11.3 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.299 178.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.876 ' HB3' HG21 ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.14 -41.82 40.3 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 179.372 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.893 HD13 HG13 ' A' ' 969' ' ' VAL . 10.8 tp -60.87 -30.6 47.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.395 -171.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.87 -42.82 60.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.173 174.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.623 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 18.1 ptp -64.34 -52.83 56.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -173.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.831 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -75.94 -35.57 59.66 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.61 -174.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.565 ' NE2' HG13 ' A' ' 984' ' ' ILE . 32.9 mt-30 -57.97 -54.98 40.83 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.815 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -57.89 -36.6 72.64 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.802 0.81 . . . . 0.0 109.454 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.587 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 14.0 tp -60.63 -62.06 2.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.963 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.978 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 1.3 pp -73.1 -23.23 60.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -172.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.48 ' N ' HD13 ' A' ' 991' ' ' LEU . 24.2 t-20 -64.69 -35.66 81.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 23.7 m -76.04 -36.83 58.93 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.886 -178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.05 -32.77 13.66 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.323 -171.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.969 ' HA ' HD13 ' A' 1028 ' ' LEU . 1.7 tm? -58.46 -38.0 76.62 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.46 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -67.72 -41.17 83.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.629 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 6.9 mm-40 -53.61 -44.3 69.34 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.3 172.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.559 ' HB3' HG12 ' A' ' 955' ' ' VAL . 4.2 mm? -69.56 -29.31 66.84 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.981 178.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.707 ' O ' ' HG2' ' A' 1002 ' ' MET . 43.8 mt -61.14 -45.5 98.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 174.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.629 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 2.9 p30 -82.91 -15.26 52.1 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.985 -0.447 . . . . 0.0 111.292 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.61 ' HA ' ' CB ' ' A' 1004 ' ' LEU . 66.1 mttm -86.37 -26.58 24.74 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.478 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.87 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 21.1 ptt? -73.93 -34.24 64.26 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.918 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.6 ttpt -73.91 -18.03 60.96 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 113.324 -1.762 . . . . 0.0 109.573 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.61 ' CB ' ' HA ' ' A' 1001 ' ' LYS . 35.9 tp -85.84 -54.72 4.34 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.178 0.924 . . . . 0.0 110.646 -173.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.22 -38.62 83.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.263 0.554 . . . . 0.0 109.848 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -23.92 54.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.059 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.918 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.9 tp-100 -69.89 -42.16 73.79 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.355 0.598 . . . . 0.0 109.75 177.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.635 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.3 OUTLIER -70.4 -62.92 1.2 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.483 177.213 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.417 ' O ' HG23 ' A' 1009 ' ' VAL . 8.5 p 40.77 34.14 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 124.714 1.259 . . . . 0.0 112.541 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.806 ' HA ' ' HE2' ' A' 1010 ' ' MET . 1.5 tpt -93.74 98.87 11.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 172.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 7.0 t -32.75 -49.26 0.22 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.9 m -79.57 -43.91 22.09 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.735 -176.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 3.6 mm? -85.36 -7.65 58.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 111.394 -175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.441 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? -60.23 -33.15 71.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.227 -176.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.5 -37.06 74.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.561 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -50.09 -39.84 43.74 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.775 0.321 . . . . 0.0 111.673 173.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.635 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 5.6 m-30 -84.89 -24.0 28.68 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.831 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.664 ' HA ' ' HE1' ' A' 1021 ' ' MET . 76.1 tttt -69.74 -44.47 70.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.826 0.346 . . . . 0.0 110.401 174.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -57.95 -57.47 12.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.475 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -57.04 -37.21 71.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.71 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.664 ' HE1' ' HA ' ' A' 1018 ' ' LYS . 40.5 ttp -64.73 -42.15 95.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.802 0.335 . . . . 0.0 110.934 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.1 tp -66.06 -41.7 90.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.943 0.402 . . . . 0.0 110.72 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 4.5 m -65.42 -30.08 70.85 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.856 0.836 . . . . 0.0 109.99 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.436 ' C ' HD22 ' A' ' 998' ' ' LEU . . . -78.91 -40.08 33.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.695 -1.138 . . . . 0.0 109.91 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.518 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.629 ' O ' HG21 ' A' 1030 ' ' VAL . 15.2 t-80 -65.13 -38.22 89.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.81 -46.79 74.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.209 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.969 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.87 -32.58 73.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 109.988 179.566 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.611 ' N ' HD21 ' A' 1028 ' ' LEU . . . -60.52 -33.96 73.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.475 170.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.629 HG21 ' O ' ' A' 1026 ' ' HIS . 85.9 t -75.82 -32.45 23.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 109.828 177.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.978 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 7.5 m-20 -59.34 -44.43 92.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.237 172.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.557 ' HB2' HD11 ' A' ' 932' ' ' LEU . . . -58.2 -52.97 63.34 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.793 170.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.526 ' O ' ' HG ' ' A' 1036 ' ' LEU . 1.6 tmtp? -53.47 -38.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.276 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.605 ' O ' HG22 ' A' 1038 ' ' VAL . 66.5 t30 -71.88 -39.89 69.31 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.911 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.772 HD21 HD23 ' A' ' 991' ' ' LEU . 17.1 tp -74.23 -29.52 61.74 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 121.279 -0.168 . . . . 0.0 110.657 -176.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.637 ' HB3' ' CG1' ' A' ' 929' ' ' VAL . 4.7 pp -70.5 -26.66 63.7 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.35 -39.68 38.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 174.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.876 HG21 ' HB3' ' A' ' 983' ' ' GLU . 19.5 t -51.77 -56.15 6.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.163 174.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.731 HG13 ' HB ' ' A' ' 925' ' ' VAL . 20.5 pt -94.24 -26.48 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -170.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.63 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 2.8 t0 -55.25 -42.63 73.72 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.511 162.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.673 ' O ' ' HG2' ' A' 1045 ' ' LYS . 21.8 mt-30 -77.61 -22.67 50.45 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.676 175.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.698 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.52 -50.79 64.69 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.055 0.455 . . . . 0.0 110.463 169.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.666 ' HG2' HG22 ' A' ' 925' ' ' VAL . 16.8 mmt180 -54.73 -38.12 66.74 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.093 0.473 . . . . 0.0 110.434 172.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.79 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 56.9 tp -69.48 -28.39 66.04 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.286 174.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.813 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 24.5 mmtp -67.84 -40.9 83.66 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.861 0.839 . . . . 0.0 109.133 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 26.6 ttt -59.23 -46.44 88.47 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.161 -1.381 . . . . 0.0 108.889 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.9 -50.8 78.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.011 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.1 m -41.84 -47.96 4.28 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -96.71 -36.55 10.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 6.4 m -86.44 -30.85 21.74 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -173.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -146.89 74.6 12.12 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.07 137.75 81.36 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 123.006 2.47 . . . . 0.0 112.729 -173.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 33.6 t60 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.852 -0.594 . . . . 0.0 109.888 179.284 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.714 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 8.4 tpt180 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 22.7 t 76.88 26.96 0.75 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.393 0.616 . . . . 0.0 110.054 -173.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.484 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 46.93 69.79 0.46 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.706 168.635 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.734 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.5 t70 -47.05 -174.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.648 -1.615 . . . . 0.0 112.67 -178.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.454 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 1.2 tmtp? -40.12 -23.05 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.998 0.919 . . . . 0.0 112.169 -177.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.661 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 7.5 m -56.36 -50.28 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 172.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.484 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 7.6 t80 -75.08 -29.75 60.76 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.011 0.91 . . . . 0.0 108.8 -176.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.37 -56.22 9.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.615 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -38.75 76.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.677 -175.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.924 ' HB ' HD12 ' A' 1039 ' ' ILE . 9.5 p -60.41 -34.13 56.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.904 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.494 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 93.4 m -69.1 -35.66 76.71 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.47 -28.03 61.7 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.618 174.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.913 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 5.1 tt -66.83 -46.8 73.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.599 ' O ' HG21 ' A' ' 937' ' ' ILE . 17.7 t -59.59 -39.85 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.165 176.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.636 ' O ' HG12 ' A' ' 937' ' ' ILE . 10.0 mmpt? -70.3 -19.03 63.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.102 0.477 . . . . 0.0 110.435 177.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.693 ' CB ' ' HB3' ' A' ' 961' ' ' ALA . . . -82.63 -25.33 33.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.92 0.39 . . . . 0.0 110.623 175.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.6 ' HB ' HG23 ' A' ' 958' ' ' VAL . 11.1 p -86.41 -10.09 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.927 172.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.636 HG12 ' O ' ' A' ' 934' ' ' LYS . 5.6 pt -83.48 -27.24 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 165.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.63 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.3 mt-10 -57.64 -39.29 76.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 164.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.605 ' HG2' ' SD ' ' A' ' 954' ' ' MET . 1.7 tmt? -57.07 -45.6 83.13 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.054 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.627 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 21.0 m -67.65 -30.06 69.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.99 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 20.1 m -79.62 -46.67 16.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.995 0.902 . . . . 0.0 108.677 -175.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.554 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 3.3 tmtm? -56.86 -45.61 82.35 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.366 -1.743 . . . . 0.0 110.786 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.882 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.1 tt -67.69 -30.34 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 O-C-N 123.302 0.376 . . . . 0.0 111.772 -176.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.4 mt-30 -50.09 -60.01 5.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.762 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 77.5 Cg_endo -97.37 34.8 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.513 1.475 . . . . 0.0 112.935 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.71 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -120.43 141.37 31.88 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.56 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 86.7 Cg_endo -88.7 -179.33 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 123.19 2.593 . . . . 0.0 109.718 165.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.631 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 9.1 Cg_endo -50.87 -32.37 37.24 Favored 'Trans proline' 0 C--O 1.247 0.932 0 C-N-CA 122.5 2.134 . . . . 0.0 112.451 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.6 -43.7 72.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.962 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.71 ' HB2' ' HB2' ' A' ' 946' ' ' ALA . 2.8 mp0 -95.71 1.72 53.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.537 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.631 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 5.9 m-30 -61.01 -48.25 82.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.519 -0.473 . . . . 0.0 109.786 176.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.006 HG12 ' HD3' ' A' ' 953' ' ' PRO . 1.3 p -75.72 -42.71 3.86 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.294 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.006 ' HD3' HG12 ' A' ' 952' ' ' VAL . 84.5 Cg_exo -52.68 -30.69 47.08 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.459 2.106 . . . . 0.0 113.753 168.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.882 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 33.8 ttp -56.88 -54.13 50.03 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 122.119 0.962 . . . . 0.0 109.189 174.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.527 HG12 ' HA ' ' A' ' 999' ' ' ILE . 42.0 t -60.64 -28.17 42.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.33 172.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 82.0 tttt -59.37 -38.28 80.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.474 ' OE1' ' HB3' ' A' ' 938' ' ' GLU . 38.9 mt-10 -59.11 -46.0 89.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.248 176.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.803 HG23 HD21 ' A' 1028 ' ' LEU . 10.0 p -75.11 -22.08 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 120.116 -0.633 . . . . 0.0 111.416 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.413 ' HA2' ' CD1' ' A' ' 995' ' ' LEU . . . -71.89 -43.83 48.72 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.646 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.78 -23.69 65.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.025 0.44 . . . . 0.0 110.732 172.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.913 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -60.42 -55.67 30.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.846 175.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.552 ' CD1' HD11 ' A' ' 991' ' ' LEU . 35.0 tp -64.37 -35.02 79.52 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.165 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 10.2 tpt180 -55.07 -57.73 10.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.187 0.518 . . . . 0.0 111.195 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 12.7 m -57.34 -38.14 73.65 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 110.646 175.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.776 HD22 HD22 ' A' 1035 ' ' LEU . 56.1 tp -64.64 -28.07 69.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.069 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.433 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 54.2 tp -62.29 -33.19 74.18 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.69 93.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.198 0.523 . . . . 0.0 110.034 172.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.661 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.8 m -67.59 -37.91 83.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.882 173.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 965' ' ' LEU . 93.8 t -56.47 -30.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.204 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.582 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.4 t70 -77.64 -22.29 50.93 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.429 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.624 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 41.8 mm-40 -71.82 -50.41 29.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 122.718 1.247 . . . . 0.0 108.499 170.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.626 ' OG ' HG23 ' A' ' 980' ' ' THR . 47.8 t -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.685 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.734 ' HA ' HD22 ' A' ' 976' ' ' LEU . 7.4 tt -60.87 -54.39 54.86 Favored Pre-proline 0 C--O 1.213 -0.827 0 CA-C-O 118.445 -0.788 . . . . 0.0 112.156 -176.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 38.0 Cg_exo -59.5 -27.49 85.09 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 121.613 1.612 . . . . 0.0 110.486 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.1 t -75.72 -14.2 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.982 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.939 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.6 pp -76.81 -41.98 2.77 Favored Pre-proline 0 CA--C 1.539 0.529 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.762 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.939 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 17.2 Cg_exo -69.03 -28.98 28.09 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.068 1.417 . . . . 0.0 110.118 172.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.32 -55.75 28.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.23 171.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.78 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 38.6 m -162.7 -42.04 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.836 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 93.6 m -51.53 -26.99 9.52 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -171.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.655 ' HA ' HG23 ' A' ' 984' ' ' ILE . 11.6 p80 -50.97 -39.12 54.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.1 0.864 . . . . 0.0 112.723 -165.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.4 mtm180 -53.73 -50.85 65.04 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.537 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.837 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.7 -48.35 32.73 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.841 -178.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.655 HG23 ' HA ' ' A' ' 981' ' ' HIS . 9.7 tp -60.4 -30.2 45.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.162 -174.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.65 -35.86 75.57 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.027 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.653 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 15.6 ptm -66.78 -52.69 41.12 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.455 -176.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.888 ' HB1' HG22 ' A' 1038 ' ' VAL . . . -80.41 -44.75 18.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -174.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.483 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -64.24 -35.29 80.32 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.033 -173.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -66.11 -42.49 89.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.415 0.626 . . . . 0.0 109.515 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -49.56 75.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.261 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.64 HD21 HD21 ' A' 1035 ' ' LEU . 2.4 pp -73.92 -29.39 62.02 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -173.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.535 ' N ' HD13 ' A' ' 991' ' ' LEU . 6.8 t30 -57.81 -43.34 85.65 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 m -76.6 -25.21 53.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.92 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -101.29 -45.56 5.3 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -172.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.931 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.31 -52.7 62.6 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.334 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.53 -43.99 80.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.517 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' 1001 ' ' LYS . 62.1 tt0 -54.23 -41.06 68.27 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.548 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.625 HD12 ' HB3' ' A' 1001 ' ' LYS . 46.0 tp -70.05 -31.22 68.73 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.693 -175.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.655 ' O ' ' HB2' ' A' 1003 ' ' LYS . 59.3 mt -58.96 -35.05 54.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.332 0.586 . . . . 0.0 109.862 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.446 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 35.5 m-80 -95.66 -10.16 30.12 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.771 178.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.625 ' HB3' HD12 ' A' ' 998' ' ' LEU . 27.1 tptt -82.75 -48.4 10.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.598 ' HE3' ' CG ' ' A' ' 951' ' ' TYR . 7.8 tpt -79.58 -26.39 41.32 Favored 'General case' 0 N--CA 1.438 -1.037 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.223 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.716 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.5 tttm -56.16 -48.96 75.31 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 168.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.444 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 31.7 tp -58.31 -43.73 88.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.351 174.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -64.16 -42.08 96.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.05 0.452 . . . . 0.0 110.926 178.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.54 -12.54 60.04 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.218 177.231 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.716 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.3 tp-100 -85.09 -23.27 28.57 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.563 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.525 ' CE2' ' HB3' ' A' 1013 ' ' LEU . 0.1 OUTLIER -85.3 -56.73 3.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.042 176.353 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 9.2 p 34.39 67.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 124.651 1.219 . . . . 0.0 112.92 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.91 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 26.4 mmt -121.76 153.41 38.31 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.012 -0.994 . . . . 0.0 108.74 176.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 32.9 p -52.26 -56.35 15.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -170.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.6 p -99.07 -20.23 16.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 111.446 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.91 ' HB2' ' HB2' ' A' 1010 ' ' MET . 2.9 mm? -86.21 -20.05 29.1 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -174.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.582 ' HB2' ' O ' ' A' 1010 ' ' MET . 0.8 OUTLIER -61.57 -48.72 79.71 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.065 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -60.3 -37.4 80.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.809 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.45 ' O ' ' HG3' ' A' 1020 ' ' GLN . 15.0 tp10 -50.78 -50.38 56.19 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.673 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.477 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.32 -25.57 61.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.792 0.33 . . . . 0.0 111.445 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' 1021 ' ' MET . 62.1 tttm -70.2 -36.04 74.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.319 0.581 . . . . 0.0 109.848 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 78.2 tttt -65.82 -29.75 70.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.267 174.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' 1016 ' ' GLU . 79.1 mt-30 -83.84 -38.33 21.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.992 -176.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -71.59 -25.94 62.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.854 177.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.9 tm? -64.82 -42.18 95.17 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 16.7 m -58.91 -35.55 73.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.452 176.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -79.06 -38.82 35.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.441 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -61.69 -32.65 72.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.098 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.495 ' O ' HG21 ' A' 1030 ' ' VAL . 77.9 t60 -72.9 -40.89 65.18 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.151 176.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.28 -37.6 87.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.204 0.526 . . . . 0.0 109.851 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.931 HD11 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -60.2 -50.33 74.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.583 173.568 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.11 70.38 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.374 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.495 HG21 ' O ' ' A' 1026 ' ' HIS . 97.5 t -65.75 -33.15 61.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.671 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.81 -39.32 73.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.857 -0.737 . . . . 0.0 109.948 -177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.766 ' HB2' HD23 ' A' ' 932' ' ' LEU . . . -62.15 -53.69 51.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.54 170.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.808 ' HA ' HD22 ' A' 1036 ' ' LEU . 96.9 mttt -63.77 -32.47 73.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -175.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.545 ' O ' HG21 ' A' 1038 ' ' VAL . 7.0 t30 -69.79 -36.88 76.07 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.006 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.776 HD22 HD22 ' A' ' 965' ' ' LEU . 13.6 tp -77.65 -24.17 49.51 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.486 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.833 ' HA ' HG13 ' A' ' 929' ' ' VAL . 0.5 OUTLIER -59.42 -43.76 93.0 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' 1041 ' ' GLN . 33.6 t70 -73.94 -22.6 59.6 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.217 177.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.888 HG22 ' HB1' ' A' ' 987' ' ' ALA . 15.1 t -76.89 -46.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.855 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.924 HD12 ' HB ' ' A' ' 929' ' ' VAL . 8.0 pt -92.62 -31.69 4.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -175.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.559 ' HB3' ' O ' ' A' 1036 ' ' LEU . 0.5 OUTLIER -54.1 -48.43 70.71 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 163.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.625 ' O ' ' HG2' ' A' 1045 ' ' LYS . 25.1 mt-30 -75.37 -22.33 57.6 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 115.063 -0.972 . . . . 0.0 111.201 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.712 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.4 -52.75 62.53 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.382 0.611 . . . . 0.0 110.255 165.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.734 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 1.2 mpt_? -59.39 -28.26 66.73 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.74 173.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.622 ' HB2' ' HA ' ' A' 1041 ' ' GLN . 84.0 mt -78.76 -23.37 45.38 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.108 173.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.836 ' HG3' ' HA ' ' A' ' 980' ' ' THR . 48.6 mmtm -63.28 -36.21 82.93 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 2.0 tmt? -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.268 176.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.5 -38.93 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.685 172.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.7 m -64.53 -41.45 96.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.601 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -73.51 -44.82 56.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.057 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 22.7 t -68.61 -34.86 76.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.014 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 63.44 92.7 0.06 OUTLIER Pre-proline 0 N--CA 1.463 0.222 0 O-C-N 123.581 0.551 . . . . 0.0 111.438 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.476 ' HG2' ' CD2' ' A' 1053 ' ' HIS . 72.4 Cg_endo -79.38 -7.16 14.92 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.377 2.051 . . . . 0.0 111.242 174.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.476 ' CD2' ' HG2' ' A' 1052 ' ' PRO . 6.2 p80 . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.817 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.561 ' HB2' ' CG1' ' A' 1047 ' ' ILE . 3.8 tpt180 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 29.9 m -85.49 27.62 0.82 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.629 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.61 68.76 0.78 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.862 0.865 . . . . 0.0 112.148 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.732 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.3 t70 -47.68 -171.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.497 -2.138 . . . . 0.0 112.511 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.592 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.0 tmtm? -27.92 -26.9 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.16 1.384 . . . . 0.0 113.8 177.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.842 HG22 ' HB2' ' A' 1043 ' ' ARG . 3.9 m -57.33 -52.65 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 174.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -77.28 -26.21 52.15 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.592 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 34.0 mt-10 -66.79 -62.28 1.53 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.761 -1.108 . . . . 0.0 112.097 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.471 ' HB2' ' CD ' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.91 -32.53 67.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.788 -0.187 . . . . 0.0 111.141 -172.452 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.913 ' HB ' HD11 ' A' 1039 ' ' ILE . 10.7 p -61.38 -31.76 51.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.888 175.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.573 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.6 m -63.46 -38.08 89.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 169.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . 0.455 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -59.09 -27.63 62.78 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.865 173.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.923 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 15.7 tp -66.03 -34.35 77.88 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 937' ' ' ILE . 57.7 t -77.01 -37.7 26.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.293 173.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.5 mmpt? -58.85 -37.57 76.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.155 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 1.08 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . . . -80.1 -24.64 40.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.708 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.553 HG13 ' HA ' ' A' ' 933' ' ' VAL . 14.5 p -79.47 -15.33 13.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.045 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.594 HG12 ' O ' ' A' ' 933' ' ' VAL . 44.1 mm -74.62 -38.53 45.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 165.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.656 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 19.2 mm-40 -52.45 -46.28 66.39 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 167.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.982 ' HG2' ' HE1' ' A' ' 954' ' ' MET . 29.3 ttp -58.32 -37.0 74.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.667 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.582 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 46.1 m -74.29 -37.96 63.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.625 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.472 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 28.3 m -78.82 -44.27 23.43 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.979 0.895 . . . . 0.0 109.452 -175.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.692 ' HD2' ' HB2' ' A' ' 954' ' ' MET . 4.5 tmtm? -59.89 -34.75 73.58 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.383 -178.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.654 ' HB ' ' HE2' ' A' ' 954' ' ' MET . 7.6 tt -77.35 -24.99 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 O-C-N 123.0 0.187 . . . . 0.0 111.143 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.728 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 87.1 mm-40 -51.39 -55.65 27.18 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.575 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.728 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.8 Cg_endo -99.89 31.59 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.148 1.899 . . . . 0.0 112.697 175.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.679 ' HB1' ' O ' ' A' ' 942' ' ' LYS . . . -102.87 126.27 33.09 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -172.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.413 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 67.7 Cg_endo -77.26 171.88 17.0 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.75 2.3 . . . . 0.0 109.298 160.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.524 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 6.3 Cg_endo -50.01 -38.71 49.76 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 122.581 2.188 . . . . 0.0 112.689 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.06 -23.95 65.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.682 ' HB3' ' HE3' ' A' ' 942' ' ' LYS . 20.4 mm-40 -102.39 -15.66 16.46 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.327 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.709 ' HB2' ' HG3' ' A' 1006 ' ' GLN . 26.8 m-85 -55.03 -51.44 66.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.295 0.569 . . . . 0.0 109.644 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.052 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -66.91 -42.75 44.69 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.728 -178.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.052 ' HD3' HG12 ' A' ' 952' ' ' VAL . 73.8 Cg_exo -58.26 -35.1 99.04 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 121.639 1.559 . . . . 0.0 113.555 168.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.982 ' HE1' ' HG2' ' A' ' 939' ' ' MET . 0.3 OUTLIER -62.44 -50.19 72.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.865 0.84 . . . . 0.0 109.737 177.492 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.604 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -60.41 -26.32 36.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.22 172.516 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.862 ' HB3' ' HZ2' ' A' ' 956' ' ' LYS . 2.6 ttpm? -66.37 -35.16 79.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -56.51 -46.73 80.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.049 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 961' ' ' ALA . 12.2 p -69.71 -22.64 25.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.957 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.24 -43.31 71.7 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.116 -1.04 . . . . 0.0 111.507 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.83 -22.2 65.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 111.067 172.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 1.08 ' HB1' ' HB3' ' A' ' 935' ' ' ALA . . . -63.47 -57.63 9.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.251 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.77 HD12 HD12 ' A' ' 965' ' ' LEU . 16.9 tp -68.82 -32.55 72.33 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.495 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -57.48 -60.5 3.55 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.419 HG23 ' OD1' ' A' ' 928' ' ' ASN . 22.5 m -55.31 -34.8 64.48 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.848 0.832 . . . . 0.0 110.293 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.77 HD12 HD12 ' A' ' 962' ' ' LEU . 2.6 tm? -64.52 -28.73 69.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.577 176.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 85.8 mt -67.5 -28.96 68.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.612 0.244 . . . . 0.0 110.654 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.56 -42.91 98.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.439 0.638 . . . . 0.0 109.497 172.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.774 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.8 m -62.36 -40.04 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.927 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.813 HG13 HD13 ' A' ' 984' ' ' ILE . 54.4 t -55.62 -31.26 28.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.197 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.534 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.0 t70 -74.46 -22.42 59.11 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.636 0.255 . . . . 0.0 110.97 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.632 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 59.6 mm-40 -71.95 -46.53 57.12 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 122.635 1.207 . . . . 0.0 109.317 169.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.727 ' HG ' HG23 ' A' ' 980' ' ' THR . 28.5 t -66.32 -24.64 66.57 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.59 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.0 tp -60.57 -50.14 86.81 Favored Pre-proline 0 C--O 1.22 -0.498 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.248 -177.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.632 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.6 Cg_exo -58.12 -28.27 83.06 Favored 'Trans proline' 0 C--N 1.358 1.062 0 CA-C-N 121.02 1.4 . . . . 0.0 110.868 169.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.6 HG11 ' O ' ' A' 1042 ' ' ALA . 40.9 t -74.45 -15.76 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.547 176.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.76 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 2.2 tt -67.92 -52.72 23.24 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.157 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 35.8 Cg_exo -61.62 -29.07 83.52 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.155 1.237 . . . . 0.0 110.719 172.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -66.52 -59.39 3.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.392 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.55 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 68.8 m -163.9 -39.03 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -173.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.727 HG23 ' HG ' ' A' ' 972' ' ' SER . 2.0 t -62.11 -16.14 50.36 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -169.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.76 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 35.7 t60 -48.44 -21.55 0.57 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.806 0.443 . . . . 0.0 112.073 -177.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 11.1 tpp180 -77.66 -54.36 6.47 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.324 0.583 . . . . 0.0 110.379 176.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.918 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.65 -46.54 25.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.312 -176.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.813 HD13 HG13 ' A' ' 969' ' ' VAL . 12.6 tt -57.8 -32.96 44.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.228 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.58 -35.26 67.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.363 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.698 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.1 ptp -61.53 -61.5 2.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.746 -176.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.721 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.42 -34.94 31.24 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.491 ' NE2' HG11 ' A' ' 969' ' ' VAL . 45.2 tt0 -64.05 -47.76 78.91 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.59 0.632 . . . . 0.0 111.25 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -68.56 -27.9 66.48 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.505 HD23 ' OD1' ' A' 1031 ' ' ASP . 7.3 tp -63.65 -42.99 98.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.857 176.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 92.6 mt -68.13 -31.29 70.78 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.035 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -56.4 -47.18 79.51 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -31.42 58.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.715 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.563 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.7 p30 -91.37 -52.09 4.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 120.069 -0.652 . . . . 0.0 112.435 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.049 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.05 -52.03 59.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.7 87.78 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.18 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.549 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 7.8 pt-20 -65.11 -32.6 74.38 Favored 'General case' 0 C--O 1.212 -0.909 0 C-N-CA 119.164 -1.015 . . . . 0.0 110.581 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.674 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 3.0 mm? -66.38 -41.86 88.77 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.647 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.504 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.3 mt -52.99 -40.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.981 173.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.509 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 51.3 m-20 -88.41 -10.07 50.49 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.343 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.674 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -85.77 -39.26 17.32 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.786 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.693 ' SD ' ' HD2' ' A' ' 951' ' ' TYR . 0.1 OUTLIER -78.72 -36.57 43.16 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 174.601 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.703 ' O ' ' HB2' ' A' 1007 ' ' GLN . 76.0 tttt -60.48 -52.48 65.02 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.139 173.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.431 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 13.7 mt -57.47 -41.17 80.11 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 174.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.799 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -61.62 -45.8 92.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 0.0 110.496 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.709 ' HG3' ' HB2' ' A' ' 951' ' ' TYR . 11.7 mm-40 -77.63 -9.55 59.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.733 0.778 . . . . 0.0 110.34 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.703 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.4 OUTLIER -87.55 -5.31 58.82 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.256 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.555 ' CE2' ' HB3' ' A' 1013 ' ' LEU . 79.5 t80 -126.54 2.64 6.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.784 179.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.771 HG22 ' HG3' ' A' 1014 ' ' GLN . 7.4 p -53.0 117.32 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.897 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 48.0 tpp -132.49 -78.5 0.5 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.593 174.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 4.3 p -144.19 -97.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.936 176.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 47.4 t -72.26 -27.17 62.32 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 174.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.585 HD13 ' H ' ' A' 1013 ' ' LEU . 5.4 mp -59.24 -31.35 68.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.631 177.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.771 ' HG3' HG22 ' A' 1009 ' ' VAL . 0.8 OUTLIER -63.74 -50.78 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.473 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -60.88 -37.73 83.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.482 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -49.88 -50.03 47.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 173.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.799 ' HD2' ' HA ' ' A' 1005 ' ' ALA . 1.1 m-30 -71.04 -28.15 64.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.559 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.463 ' HB2' HE22 ' A' 1014 ' ' GLN . 28.8 ttpp -74.86 -25.12 58.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.207 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 46.4 tttp -65.86 -61.0 2.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.173 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.03 -41.83 26.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.759 168.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.498 ' HG3' ' HE2' ' A' 1002 ' ' MET . 1.8 tmt? -63.42 -44.64 94.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.837 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 50.8 tp -60.5 -37.66 81.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.779 0.324 . . . . 0.0 111.42 -177.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 25.9 m -68.93 -31.77 70.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.573 0.702 . . . . 0.0 110.15 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -79.25 -39.26 33.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.86 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.55 ' HB1' ' HE3' ' A' ' 939' ' ' MET . . . -63.84 -36.28 83.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.758 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.512 ' O ' HG21 ' A' 1030 ' ' VAL . 63.6 t60 -66.52 -31.16 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.493 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.94 -50.54 55.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.375 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 1.049 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.97 -32.07 73.07 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.15 0.5 . . . . 0.0 109.755 -175.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.625 ' N ' HD21 ' A' 1028 ' ' LEU . . . -61.69 -44.84 96.17 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.091 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' 1026 ' ' HIS . 64.5 t -77.25 -18.99 14.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.535 ' C ' HD23 ' A' ' 991' ' ' LEU . 69.3 m-20 -85.73 -34.42 21.23 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.702 176.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.649 ' HB2' ' HG ' ' A' ' 932' ' ' LEU . . . -53.83 -49.14 69.06 Favored 'General case' 0 C--N 1.345 0.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 161.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.748 ' O ' ' HG ' ' A' 1036 ' ' LEU . 56.8 tttm -61.14 -28.38 69.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.638 177.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.582 ' O ' HG22 ' A' 1038 ' ' VAL . 67.2 t30 -74.74 -34.32 62.5 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.9 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.695 ' CD2' HD11 ' A' ' 965' ' ' LEU . 25.1 tp -78.09 -23.69 47.86 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.688 -177.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.878 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.2 pp -63.6 -43.27 97.39 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.415 ' N ' HD12 ' A' 1036 ' ' LEU . 16.5 t70 -62.68 -43.73 98.05 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.101 175.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.918 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 44.2 t -53.4 -69.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.575 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.913 HD11 ' HB ' ' A' ' 929' ' ' VAL . 7.1 pt -77.94 -26.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.2 t70 -49.94 -48.21 52.05 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 163.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -78.72 -24.54 44.87 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.192 177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.719 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.88 -56.01 24.16 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 118.921 0.782 . . . . 0.0 111.537 171.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.842 ' HB2' HG22 ' A' ' 925' ' ' VAL . 0.0 OUTLIER -55.68 -30.38 60.97 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.564 176.194 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 41.6 tp -74.77 -37.27 62.49 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.591 172.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 13.6 mptt -53.68 -38.98 64.74 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.018 0.927 . . . . 0.0 109.869 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.8 ttt -60.54 -44.59 95.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.583 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.561 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 43.3 mm -70.52 -28.7 35.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.448 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' 1045 ' ' LYS . 67.8 m -58.9 -54.65 44.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.412 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -80.06 -12.34 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.34 0.591 . . . . 0.0 110.114 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.514 ' O ' ' HD3' ' A' 1052 ' ' PRO . 28.3 t -83.51 -1.03 52.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.561 0.696 . . . . 0.0 109.608 173.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -107.26 92.06 7.57 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.818 175.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.514 ' HD3' ' O ' ' A' 1050 ' ' SER . 16.6 Cg_exo -69.1 136.3 34.37 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.478 2.118 . . . . 0.0 111.279 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 57.9 m-70 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.309 -0.853 . . . . 0.0 109.542 178.536 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.861 ' HD3' ' HB2' ' A' 1044 ' ' LEU . 2.0 ttt-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 43.5 t 62.66 10.3 4.07 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 122.703 0.401 . . . . 0.0 111.695 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 46.02 52.74 9.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 123.364 0.666 . . . . 0.0 110.85 -176.146 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.485 ' O ' ' N ' ' A' ' 925' ' ' VAL . 9.4 t70 -45.58 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 125.817 1.948 . . . . 0.0 112.182 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.626 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.6 tmtp? -44.82 -14.18 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.515 0.726 . . . . 0.0 111.722 -178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.819 ' HA ' HG23 ' A' ' 968' ' ' THR . 9.8 m -63.15 -53.3 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.15 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.582 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 59.2 t80 -77.62 -28.35 51.43 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.6 mt-10 -62.71 -66.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.175 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.505 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.5 t30 -66.71 -36.17 81.85 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.264 -172.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.855 ' HA ' HD11 ' A' ' 932' ' ' LEU . 9.9 p -61.66 -39.48 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 120.932 0.396 . . . . 0.0 111.339 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.553 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 59.9 m -66.24 -33.36 75.57 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.26 -30.04 60.76 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 114.55 -1.204 . . . . 0.0 112.757 172.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 1.032 HD12 ' HB2' ' A' ' 965' ' ' LEU . 6.9 mp -63.04 -45.85 90.33 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 117.941 0.871 . . . . 0.0 109.622 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.501 ' HA ' HG11 ' A' ' 936' ' ' VAL . 61.8 t -63.21 -37.34 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.648 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.556 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.5 mmpt? -68.4 -31.57 71.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.209 0.528 . . . . 0.0 110.373 175.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -77.56 -25.32 49.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.522 ' HA ' HG13 ' A' ' 958' ' ' VAL . 7.5 p -81.3 -6.71 10.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 119.714 -0.794 . . . . 0.0 109.34 172.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 66.1 mt -75.91 -33.75 26.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 165.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 24.6 mm-40 -53.24 -40.7 64.79 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.66 168.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.887 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.5 tmm? -58.12 -46.9 84.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.941 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.596 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 46.9 m -64.08 -33.08 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.201 179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.693 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 13.3 m -77.46 -45.49 25.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.953 0.882 . . . . 0.0 108.938 -176.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.531 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 8.5 mmtp -55.94 -47.1 78.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.063 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.615 ' HA ' ' OE1' ' A' ' 950' ' ' GLU . 10.9 tt -68.89 -28.89 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.515 -174.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.625 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 75.8 mt-30 -53.28 -62.03 4.12 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.693 ' HD3' ' O ' ' A' ' 941' ' ' SER . 5.7 Cg_exo -77.64 -35.69 1.44 Allowed 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.703 1.602 . . . . 0.0 114.88 -170.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.494 ' HB3' ' CG ' ' A' ' 950' ' ' GLU . . . -105.92 164.21 15.47 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -167.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.639 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 10.8 Cg_exo -74.26 179.99 5.29 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 123.845 3.03 . . . . 0.0 110.94 169.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.69 -15.56 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 124.134 3.223 . . . . 0.0 115.323 -171.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 7.0 pt-20 -57.72 -20.07 31.91 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.395 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.639 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.2 OUTLIER -87.78 -22.01 24.78 Favored 'General case' 0 CA--C 1.511 -0.524 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.659 174.288 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.687 ' HD2' ' HA ' ' A' 1002 ' ' MET . 0.3 OUTLIER -56.22 -50.47 71.18 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 123.814 0.697 . . . . 0.0 110.245 -172.246 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.021 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -75.11 -45.04 4.74 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.635 178.574 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.021 ' HD3' HG12 ' A' ' 952' ' ' VAL . 85.4 Cg_exo -56.74 -27.49 71.3 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 121.599 1.532 . . . . 0.0 114.731 172.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.887 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 26.4 ptt? -74.61 -35.68 62.94 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.758 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 1.062 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -63.21 -27.49 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.473 170.543 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.711 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.7 ttpp -56.07 -41.73 75.55 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.428 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.1 mm-40 -58.26 -46.25 86.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.36 -1.291 . . . . 0.0 111.558 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.528 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 3.3 m -74.36 -28.46 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.8 -42.35 38.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.048 -1.073 . . . . 0.0 111.861 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 57.2 tp -58.61 -34.52 71.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.244 0.545 . . . . 0.0 109.595 171.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.858 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -58.61 -48.42 81.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.736 174.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 17.9 tp -68.7 -36.85 78.99 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.726 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 46.6 ttp180 -63.77 -47.9 79.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.605 -0.684 . . . . 0.0 111.595 176.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 p -56.81 -35.7 69.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.318 0.58 . . . . 0.0 109.869 171.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 1.032 ' HB2' HD12 ' A' ' 932' ' ' LEU . 63.7 tp -64.41 -34.51 78.34 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.84 176.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 88.5 mt -58.25 -33.82 69.79 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.099 178.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.4 -43.06 91.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.63 0.728 . . . . 0.0 109.647 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.819 HG23 ' HA ' ' A' ' 925' ' ' VAL . 6.2 m -60.29 -43.4 96.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.861 173.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.554 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 76.3 t -55.3 -35.99 38.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.905 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.627 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 16.2 t70 -71.63 -22.33 61.71 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 120.504 0.193 . . . . 0.0 111.447 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.54 ' O ' HG22 ' A' ' 975' ' ' VAL . 7.2 mm-40 -70.06 -47.87 60.18 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 122.838 1.304 . . . . 0.0 108.379 170.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.614 ' OG ' HG23 ' A' ' 980' ' ' THR . 43.7 t -67.83 -25.44 65.56 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.657 -1.611 . . . . 0.0 111.67 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.626 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.6 mt -63.16 -51.34 70.38 Favored Pre-proline 0 C--O 1.218 -0.579 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.6 Cg_endo -57.48 -29.42 84.64 Favored 'Trans proline' 0 C--N 1.352 0.762 0 CA-C-N 121.594 1.605 . . . . 0.0 110.729 169.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.614 HG11 ' O ' ' A' 1042 ' ' ALA . 2.5 t -76.76 -11.29 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 119.899 -0.721 . . . . 0.0 110.885 175.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.626 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.2 tt -65.19 -56.08 22.22 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.796 176.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.521 ' HD3' ' HB3' ' A' ' 976' ' ' LEU . 31.5 Cg_exo -60.5 -31.99 93.11 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 121.297 1.331 . . . . 0.0 110.628 174.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.05 -53.06 61.82 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.315 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.757 ' CB ' ' HB3' ' A' 1045 ' ' LYS . 3.3 m -169.33 -38.32 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.712 HG21 ' HB ' ' A' ' 984' ' ' ILE . 5.5 m -57.04 -17.42 10.07 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.62 ' HA ' ' HG ' ' A' ' 976' ' ' LEU . 13.7 p-80 -48.6 -18.84 0.28 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -77.62 -54.89 5.85 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.059 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 1.034 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.8 OUTLIER -79.84 -44.21 20.93 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.315 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.712 ' HB ' HG21 ' A' ' 980' ' ' THR . 0.0 OUTLIER -59.25 -33.33 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -173.67 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.37 -36.05 68.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.661 174.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptm -67.34 -56.24 10.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.78 -176.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.573 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.66 -39.94 23.61 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 1.058 ' HA ' HD12 ' A' ' 991' ' ' LEU . 25.0 tm0? -67.47 -38.99 85.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.688 -173.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -72.5 -24.67 61.19 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.479 0.657 . . . . 0.0 109.268 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.457 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.4 tp -72.79 -41.13 65.3 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.561 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.058 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.5 mt -59.01 -50.51 73.82 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.216 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -55.5 -38.83 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.818 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -67.51 -38.77 84.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.408 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.688 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -113.31 -30.13 7.01 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -170.669 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.113 ' HA ' HD12 ' A' 1028 ' ' LEU . 4.2 mm? -55.95 -51.16 68.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 166.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.753 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -60.65 -44.33 96.54 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.582 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.571 ' HG3' ' HE2' ' A' 1001 ' ' LYS . 6.3 tp10 -51.97 -42.93 63.29 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.983 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.686 ' O ' ' HG2' ' A' 1002 ' ' MET . 3.8 mm? -70.94 -33.1 70.17 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.568 -175.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.795 ' HA ' HG11 ' A' ' 955' ' ' VAL . 8.2 pt -62.65 -23.57 33.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.095 177.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.739 ' O ' ' HB2' ' A' 1004 ' ' LEU . 17.0 m-80 -94.52 -10.3 32.64 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.262 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.571 ' HE2' ' HG3' ' A' ' 997' ' ' GLU . 73.0 mmtt -83.36 -40.14 19.81 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.062 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 8.6 mmt -70.81 -44.2 67.06 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' 1007 ' ' GLN . 86.2 tttt -57.62 -45.69 85.07 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.464 173.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.739 ' HB2' ' O ' ' A' 1000 ' ' ASN . 17.0 tp -55.09 -53.53 54.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.454 0.702 . . . . 0.0 112.824 172.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.25 -41.74 93.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.077 0.465 . . . . 0.0 110.58 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.06 -18.05 59.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.555 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.729 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.4 tp-100 -75.94 -41.03 52.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.362 178.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.577 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.9 OUTLIER -71.04 -54.6 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.354 176.527 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' 1009 ' ' VAL . 9.1 p 34.15 78.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.679 1.237 . . . . 0.0 113.053 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.523 ' H ' ' HB2' ' A' 1014 ' ' GLN . 22.8 ttt -135.65 124.31 23.76 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.2 t -39.2 -49.41 1.86 Allowed 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -166.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 7.9 t -99.69 -35.66 9.74 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 121.703 -0.623 . . . . 0.0 111.608 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.09 -9.81 57.52 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -171.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.549 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? -64.01 -30.93 71.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.795 0.331 . . . . 0.0 110.121 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 1.6 mp0 -61.7 -33.37 73.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.765 -176.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.73 -47.75 50.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.682 0.277 . . . . 0.0 111.232 169.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.615 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.9 m-30 -76.12 -22.09 55.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.195 0.521 . . . . 0.0 110.508 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.678 ' HG3' ' OH ' ' A' ' 951' ' ' TYR . 75.7 tttt -73.03 -41.81 63.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.164 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.84 -18.64 61.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.962 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -77.24 -40.57 44.33 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' 1002 ' ' MET . 1.5 tmt? -66.04 -38.83 89.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.869 174.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 7.6 tt -55.38 -50.8 68.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.895 0.379 . . . . 0.0 110.405 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 13.1 m -67.62 -34.64 77.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.486 0.66 . . . . 0.0 110.808 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -74.36 -37.49 63.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.097 -176.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -66.26 -32.04 73.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.649 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.563 ' O ' HG22 ' A' 1030 ' ' VAL . 12.0 t-80 -66.67 -32.49 73.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.4 -50.97 57.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.923 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 1.113 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -67.4 -30.7 70.53 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.261 0.553 . . . . 0.0 110.304 -178.168 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.634 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.52 -41.41 76.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.853 170.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' 1026 ' ' HIS . 88.8 t -66.67 -31.12 52.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.649 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.688 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 5.8 m-20 -59.07 -47.48 85.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.046 0.45 . . . . 0.0 109.961 176.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.12 87.19 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.567 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.748 ' O ' ' HG ' ' A' 1036 ' ' LEU . 31.0 mmmt -63.31 -36.63 84.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.123 0.487 . . . . 0.0 111.358 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.646 ' O ' HG21 ' A' 1038 ' ' VAL . 2.3 t30 -68.71 -39.67 80.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.381 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.851 HD23 HD11 ' A' ' 991' ' ' LEU . 12.1 tp -78.86 -22.23 46.35 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.866 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' A' 1033 ' ' LYS . 4.1 pp -67.95 -31.59 71.44 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.644 ' O ' ' HB2' ' A' 1041 ' ' GLN . 28.3 t70 -75.89 -31.89 59.41 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.512 171.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 1.034 HG13 ' HB3' ' A' ' 983' ' ' GLU . 33.9 t -64.04 -67.31 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.297 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.734 HG12 ' O ' ' A' 1035 ' ' LEU . 7.7 pt -80.99 -32.23 12.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.061 -170.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.582 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 12.6 t0 -55.11 -45.93 75.52 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 166.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.644 ' HB2' ' O ' ' A' 1037 ' ' ASP . 2.7 mp0 -67.86 -28.65 67.72 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.147 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.614 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -52.81 -53.18 52.13 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-O 120.861 0.362 . . . . 0.0 111.063 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.446 ' HB3' ' HG3' ' A' ' 920' ' ' ARG . 0.9 OUTLIER -54.21 -36.6 63.64 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.008 176.052 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.861 ' HB2' ' HD3' ' A' ' 920' ' ' ARG . 14.6 tp -76.81 -25.25 53.07 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.982 -0.449 . . . . 0.0 111.539 173.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.757 ' HB3' ' CB ' ' A' ' 979' ' ' SER . 25.0 mmtp -63.21 -21.39 66.19 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 172.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.411 ' HB3' ' O ' ' A' 1043 ' ' ARG . 11.9 tmm? -74.89 -43.91 51.77 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.728 -1.123 . . . . 0.0 108.913 176.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.725 HG21 ' HA ' ' A' 1052 ' ' PRO . 3.9 mp -61.31 -41.57 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 121.609 0.719 . . . . 0.0 109.868 170.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.541 ' HB2' ' HA ' ' A' 1045 ' ' LYS . 32.8 m -69.35 -12.73 61.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.093 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.44 -69.39 0.41 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 7.1 t -176.35 29.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.387 . . . . 0.0 110.733 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.686 ' O ' ' HA ' ' A' 1047 ' ' ILE . 71.5 ttt180 -144.87 97.96 4.86 Favored Pre-proline 0 C--N 1.324 -0.501 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.085 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.725 ' HA ' HG21 ' A' 1047 ' ' ILE . 17.4 Cg_exo -68.21 -26.9 35.62 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.753 2.302 . . . . 0.0 111.645 176.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 18.7 t-80 . . . . . 0 C--O 1.245 0.868 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.36 179.939 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.548 ' HG3' ' HB3' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 120.964 0.411 . . . . 0.0 110.17 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 17.7 p -91.31 25.38 2.58 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.551 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.479 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.28 54.71 7.02 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.218 -175.553 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.48 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -47.01 -173.27 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 125.763 1.914 . . . . 0.0 112.084 -176.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.579 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.0 tmtm? -39.01 -22.74 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.385 0.674 . . . . 0.0 111.685 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 1.008 ' HA ' HG22 ' A' ' 968' ' ' THR . 14.8 m -56.64 -52.82 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.599 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.426 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 12.9 t80 -77.91 -32.99 52.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -61.19 -58.57 7.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 113.208 -1.815 . . . . 0.0 112.102 -174.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.446 ' OD1' HG21 ' A' ' 964' ' ' THR . 0.2 OUTLIER -71.99 -32.27 67.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.59 -172.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.554 ' HA ' HD13 ' A' ' 965' ' ' LEU . 39.9 t -63.33 -35.09 70.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.092 173.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.528 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -65.33 -39.05 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 169.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.07 -29.75 62.85 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.935 175.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.79 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 22.5 tp -65.39 -38.79 91.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.487 ' O ' HG12 ' A' ' 936' ' ' VAL . 38.2 t -67.66 -40.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.13 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -61.8 -30.6 70.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.159 0.504 . . . . 0.0 110.107 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.595 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -76.65 -26.33 54.72 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.354 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 933' ' ' VAL . 8.0 p -85.04 -4.97 9.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.899 0.857 . . . . 0.0 109.092 172.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.517 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 62.4 mt -81.46 -38.63 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 163.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.597 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 73.0 mm-40 -52.77 -40.28 63.0 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.364 167.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.678 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.26 -44.93 92.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.839 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.608 ' O ' HG22 ' A' ' 943' ' ' ILE . 5.0 p -74.57 -27.36 60.46 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.418 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.4 p -79.13 -44.98 20.93 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.703 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 0.1 OUTLIER -51.35 -43.53 61.83 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 113.304 -1.771 . . . . 0.0 110.889 172.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.782 HG12 ' HE2' ' A' ' 954' ' ' MET . 0.3 OUTLIER -67.54 -29.37 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 O-C-N 123.841 0.713 . . . . 0.0 110.746 -175.498 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.796 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.8 mm-40 -52.01 -58.58 10.81 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-O 119.398 -0.334 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.796 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 56.6 Cg_endo -101.25 26.22 0.13 Allowed 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 121.884 1.723 . . . . 0.0 113.166 175.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -83.86 121.87 76.1 Favored Pre-proline 0 C--N 1.33 -0.249 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -174.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.73 ' HD2' ' HG3' ' A' ' 950' ' ' GLU . 92.7 Cg_endo -82.04 -176.2 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.814 2.343 . . . . 0.0 109.568 156.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.932 ' HA ' ' HD2' ' A' ' 951' ' ' TYR . 8.9 Cg_endo -51.71 -41.15 63.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.456 2.104 . . . . 0.0 112.743 177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -64.69 -7.41 10.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.021 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.73 ' HG3' ' HD2' ' A' ' 947' ' ' PRO . 5.9 mm-40 -109.46 -17.09 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.261 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.932 ' HD2' ' HA ' ' A' ' 948' ' ' PRO . 31.8 m-85 -59.42 -37.3 77.7 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.056 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.41 -50.41 2.77 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.621 177.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.056 ' HD3' HG12 ' A' ' 952' ' ' VAL . 89.1 Cg_exo -56.31 -36.74 97.36 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.727 2.284 . . . . 0.0 114.854 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.792 ' HE1' ' HA ' ' A' ' 951' ' ' TYR . 20.6 ptp -60.14 -47.52 85.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.747 0.784 . . . . 0.0 108.973 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.673 ' HB ' ' HB3' ' A' 1002 ' ' MET . 61.8 t -65.22 -28.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.334 172.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -62.06 -37.34 84.63 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 938' ' ' GLU . 71.1 mm-40 -55.74 -47.14 77.44 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.608 174.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 1.008 HG21 HD23 ' A' ' 998' ' ' LEU . 3.6 m -72.47 -28.88 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.791 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.511 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -73.39 -44.92 32.12 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.063 -1.065 . . . . 0.0 111.783 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.65 -31.72 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.79 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.41 -55.23 36.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.531 178.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 4.6 tt -65.34 -32.77 74.58 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.327 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.479 ' HA ' ' HD3' ' A' ' 963' ' ' ARG . 30.8 mmt180 -65.02 -48.64 73.19 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 122.009 -0.432 . . . . 0.0 111.583 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.446 HG21 ' OD1' ' A' ' 928' ' ' ASN . 11.1 m -60.04 -37.46 79.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.358 0.599 . . . . 0.0 109.937 172.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.637 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 3.2 tt -59.03 -30.43 68.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.49 173.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.507 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 52.5 tp -66.6 -31.44 72.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.536 ' O ' ' HB3' ' A' ' 970' ' ' ASP . . . -65.65 -41.45 92.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.942 0.877 . . . . 0.0 109.658 173.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 1.008 HG22 ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -60.96 -38.6 86.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.742 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 70.7 t -55.4 -30.79 26.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.001 171.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.624 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.7 t70 -65.45 -29.59 70.28 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 122.406 -0.184 . . . . 0.0 111.313 177.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.605 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 54.2 mm-40 -65.95 -52.11 52.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 122.293 1.044 . . . . 0.0 109.658 172.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.501 ' HB3' ' CG1' ' A' 1039 ' ' ILE . 60.7 p -66.35 -23.3 66.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.153 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.85 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 65.1 tp -58.66 -54.72 53.39 Favored Pre-proline 0 C--O 1.217 -0.606 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 26.1 Cg_exo -64.86 -25.55 60.18 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.397 1.535 . . . . 0.0 110.319 172.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.581 HG11 ' O ' ' A' 1042 ' ' ALA . 5.3 t -75.6 -16.37 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 119.909 -0.717 . . . . 0.0 111.5 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.85 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 4.6 pp -80.45 -38.48 1.09 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 118.344 -0.836 . . . . 0.0 113.001 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.705 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 21.9 Cg_exo -66.34 -26.63 48.28 Favored 'Trans proline' 0 C--N 1.36 1.132 0 CA-C-N 121.578 1.599 . . . . 0.0 110.0 171.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.641 ' HB3' ' HG3' ' A' 1049 ' ' GLN . . . -69.84 -51.82 30.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.266 173.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.839 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.8 m -162.57 -48.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.948 HG21 ' HB ' ' A' ' 984' ' ' ILE . 51.4 m -46.92 -20.45 0.14 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.644 ' HB2' ' O ' ' A' ' 976' ' ' LEU . 19.5 t-80 -51.72 -20.15 1.97 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -76.81 -54.45 6.6 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.941 -177.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 1.055 ' HB2' HG22 ' A' 1038 ' ' VAL . 7.9 pm0 -78.64 -37.39 42.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 121.813 -0.554 . . . . 0.0 111.839 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.948 ' HB ' HG21 ' A' ' 980' ' ' THR . 9.8 tp -62.03 -21.88 27.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.45 -47.13 51.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.059 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.513 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 22.7 ptp -72.26 -46.26 56.63 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.768 -170.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.648 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.73 -45.55 20.95 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -175.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.973 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.9 tt0 -62.21 -43.68 98.29 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.178 -175.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.638 ' HZ1' ' HB3' ' A' ' 989' ' ' LYS . 9.8 mtpm? -66.63 -32.61 74.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.415 0.626 . . . . 0.0 109.474 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.817 HD22 HD21 ' A' 1034 ' ' ASN . 3.3 tp -65.13 -43.72 91.01 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.378 177.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.037 HD21 ' HB3' ' A' 1031 ' ' ASP . 22.8 mt -60.0 -45.98 90.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.01 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.94 -41.55 71.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.654 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.1 m -73.04 -34.37 66.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.256 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.672 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -103.97 -31.67 9.62 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -170.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.822 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.9 OUTLIER -57.93 -38.46 75.96 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 165.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.488 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -55.57 -48.98 73.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.685 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -65.75 -32.31 73.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.718 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 1.008 HD23 HG21 ' A' ' 958' ' ' VAL . 14.1 tp -71.34 -26.78 62.97 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 119.11 -1.036 . . . . 0.0 108.898 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 64.4 mt -62.36 -27.14 42.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.375 0.607 . . . . 0.0 109.605 169.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.688 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 77.5 m-20 -80.68 -6.71 58.77 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.648 ' HA ' ' HG3' ' A' 1021 ' ' MET . 58.2 tttm -80.07 -45.24 18.62 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 172.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.84 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 17.7 ptp -64.34 -38.0 89.47 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 175.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.836 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.6 tttp -67.87 -61.94 1.64 Allowed 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.712 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' A' 1000 ' ' ASN . 4.8 tp -56.49 -56.08 25.72 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -173.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.6 -46.62 83.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.16 0.505 . . . . 0.0 110.785 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -24.14 54.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.952 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.836 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.0 OUTLIER -69.07 -46.08 68.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.825 -173.456 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.63 ' HB2' ' CE2' ' A' 1017 ' ' TYR . 0.0 OUTLIER -121.81 32.92 5.67 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.989 -0.684 . . . . 0.0 111.256 175.681 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.601 HG22 ' HB3' ' A' ' 948' ' ' PRO . 7.2 p -46.78 122.81 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.567 0.699 . . . . 0.0 110.991 173.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.811 ' H ' ' HB2' ' A' 1014 ' ' GLN . 0.4 OUTLIER -153.97 147.55 25.15 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -177.265 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 11.9 t -61.11 -6.87 2.2 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 46.7 t -135.32 -47.21 0.7 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.869 0.366 . . . . 0.0 111.222 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 7.5 mp -73.04 -20.71 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.811 ' HB2' ' H ' ' A' 1010 ' ' MET . 0.8 OUTLIER -56.77 -42.62 79.7 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.061 0.226 . . . . 0.0 111.498 -173.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -52.82 -38.27 61.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -165.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -47.19 -51.56 18.15 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.079 0.466 . . . . 0.0 111.684 171.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.63 ' CE2' ' HB2' ' A' 1008 ' ' TYR . 3.2 m-85 -68.33 -23.87 64.76 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.968 0.889 . . . . 0.0 109.204 -173.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.71 ' HB2' HE22 ' A' 1014 ' ' GLN . 85.3 tttt -79.41 -41.66 27.17 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.05 176.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 79.0 tttt -77.96 -33.76 51.38 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.59 0.71 . . . . 0.0 111.643 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.01 -45.74 14.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.276 -0.874 . . . . 0.0 108.9 -171.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.768 ' HA ' ' HE3' ' A' 1021 ' ' MET . 25.8 mmt -75.37 -17.74 60.14 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.824 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' 1018 ' ' LYS . 58.8 tp -63.45 -43.53 97.13 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 171.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.3 m -61.62 -28.65 69.52 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.3 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.82 -30.92 51.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.742 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -67.45 -40.61 85.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.327 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.526 ' O ' HG23 ' A' 1030 ' ' VAL . 14.8 t-80 -58.39 -38.02 76.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.103 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.0 -49.54 69.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.822 HD11 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -68.3 -29.05 67.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.34 0.59 . . . . 0.0 110.07 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.489 ' N ' HD22 ' A' 1028 ' ' LEU . . . -59.75 -42.68 93.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.604 172.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' 1026 ' ' HIS . 47.7 t -67.03 -31.4 53.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.957 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 1.037 ' HB3' HD21 ' A' ' 991' ' ' LEU . 2.4 m-20 -56.19 -46.93 79.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.665 173.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.79 -53.53 57.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.313 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -54.1 -42.0 68.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.905 0.384 . . . . 0.0 111.646 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.817 HD21 HD22 ' A' ' 990' ' ' LEU . 50.6 t30 -63.72 -49.83 71.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.823 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.92 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -73.13 -27.57 61.75 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.451 ' N ' HG11 ' A' ' 929' ' ' VAL . 4.4 tt -57.5 -35.86 70.77 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.527 0.731 . . . . 0.0 110.737 177.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -92.51 -33.68 14.37 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 1.055 HG22 ' HB2' ' A' ' 983' ' ' GLU . 2.0 t -56.09 -46.57 80.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.367 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.563 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.2 tt -93.48 -28.51 4.38 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.938 -172.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 7.5 t70 -57.33 -42.81 82.61 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 161.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' 1045 ' ' LYS . 15.2 mm100 -69.81 -31.44 69.35 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.707 174.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.581 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -53.82 -56.11 20.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.05 0.452 . . . . 0.0 110.553 171.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.716 ' HB2' HG22 ' A' ' 925' ' ' VAL . 7.2 tpt180 -57.29 -33.86 68.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.618 177.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.444 HD11 HH11 ' A' ' 920' ' ' ARG . 63.3 tp -69.01 -41.82 77.25 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 121.094 -0.243 . . . . 0.0 111.066 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.839 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 42.1 mmtm -51.09 -37.39 45.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.029 0.919 . . . . 0.0 110.079 174.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.434 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 28.0 ttt -68.82 -38.06 79.61 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.271 -1.331 . . . . 0.0 110.017 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.701 HG23 ' HG3' ' A' 1052 ' ' PRO . 42.8 mm -67.56 -36.3 75.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.38 173.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.519 ' HB2' ' O ' ' A' 1045 ' ' LYS . 71.0 m -56.15 -51.39 68.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.305 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.641 ' HG3' ' HB3' ' A' ' 978' ' ' ALA . 15.8 mm100 -65.88 -30.14 70.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.219 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 22.0 m -79.51 -14.54 58.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.526 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 66.03 106.44 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.498 -177.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.701 ' HG3' HG23 ' A' 1047 ' ' ILE . 5.8 Cg_exo -77.24 -82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.637 2.224 . . . . 0.0 111.339 177.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 29.6 m170 . . . . . 0 C--O 1.243 0.73 0 CA-C-O 118.389 -0.815 . . . . 0.0 109.212 174.517 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.707 ' HB3' ' HD3' ' A' 1043 ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.624 0.25 . . . . 0.0 110.791 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.616 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 28.4 t -68.89 139.09 55.13 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 166.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.639 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER -72.02 67.91 0.66 Allowed 'General case' 0 CA--C 1.499 -1.002 0 C-N-CA 122.538 0.335 . . . . 0.0 111.524 -173.463 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 925' ' ' VAL . 8.2 t70 -47.87 -173.92 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 O-C-N 125.902 2.001 . . . . 0.0 112.325 -173.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.504 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 5.1 tmtp? -39.27 -19.76 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 124.042 0.937 . . . . 0.0 112.508 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.924 ' HA ' HG21 ' A' ' 968' ' ' THR . 3.7 m -62.01 -57.16 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 123.037 0.535 . . . . 0.0 112.193 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.536 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 23.3 t80 -78.97 -31.28 44.87 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 122.206 1.003 . . . . 0.0 108.764 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 7.8 mm-40 -60.84 -59.49 5.3 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.953 -1.476 . . . . 0.0 112.188 -175.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.497 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 5.1 t30 -73.65 -32.54 64.05 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.671 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.801 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.7 p -62.63 -37.11 78.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 119.904 -0.719 . . . . 0.0 110.423 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.521 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 31.0 m -66.65 -33.94 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.291 0.567 . . . . 0.0 109.586 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.27 -31.07 65.29 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.381 173.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.697 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 25.9 tp -62.99 -41.78 99.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.004 0.43 . . . . 0.0 109.886 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.54 ' O ' HG12 ' A' ' 937' ' ' ILE . 48.2 t -62.3 -43.02 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 0.0 110.011 174.081 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -55.95 -40.89 73.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.724 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.36 -31.63 62.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.864 -177.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.503 HG12 ' HA ' ' A' ' 933' ' ' VAL . 13.0 p -77.41 -16.8 14.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.441 174.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.5 mm -72.55 -42.46 63.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 165.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 45.1 mt-10 -54.44 -37.2 64.87 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.937 172.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.546 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 42.9 ttp -57.94 -45.86 85.94 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.624 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.5 t -72.48 -32.84 66.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.857 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.578 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 24.0 m -77.64 -47.01 20.33 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.999 0.905 . . . . 0.0 109.968 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.542 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -78.86 -15.94 57.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.477 -174.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.85 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 6.8 tt -78.99 -25.62 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.106 172.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.69 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.2 mm-40 -50.93 -53.72 44.81 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.69 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.1 Cg_endo -104.43 36.26 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.09 1.86 . . . . 0.0 114.319 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.679 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -138.16 155.53 74.26 Favored Pre-proline 0 N--CA 1.466 0.33 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.516 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 50.5 Cg_endo -90.47 -176.72 1.1 Allowed 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 124.043 3.162 . . . . 0.0 112.091 176.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.784 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.8 Cg_exo -51.96 -31.77 44.99 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.976 2.451 . . . . 0.0 113.086 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.421 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 47.1 mt-10 -53.99 -36.17 62.63 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.557 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.679 ' HB2' ' HB2' ' A' ' 946' ' ' ALA . 2.4 mp0 -98.65 0.09 44.03 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.784 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 15.8 m-30 -61.27 -41.21 96.55 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.034 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -75.02 -51.25 3.64 Favored Pre-proline 0 CA--C 1.557 1.212 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.729 176.05 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.998 ' HD3' HG11 ' A' ' 952' ' ' VAL . 79.9 Cg_exo -51.54 -33.74 49.19 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.408 2.072 . . . . 0.0 115.112 173.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.85 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 27.3 ptt? -67.48 -45.84 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.182 0.515 . . . . 0.0 109.997 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.693 HG13 ' HG ' ' A' ' 998' ' ' LEU . 87.2 t -64.67 -27.14 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.502 173.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.863 ' HB3' ' HZ2' ' A' ' 956' ' ' LYS . 3.7 ttpm? -59.4 -37.02 76.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -54.69 -46.09 74.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.882 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.45 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.1 t -69.95 -36.23 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.851 176.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.531 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -69.02 -44.46 67.16 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.358 -0.925 . . . . 0.0 112.872 -176.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.21 -32.34 72.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.884 0.374 . . . . 0.0 110.486 171.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.697 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -63.19 -55.92 21.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.616 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.479 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 1.8 tm? -63.8 -35.03 79.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.527 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -57.42 -57.38 12.93 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 121.827 -0.546 . . . . 0.0 111.114 171.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -55.81 -31.07 62.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.367 0.603 . . . . 0.0 110.65 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.731 HD13 HD23 ' A' 1035 ' ' LEU . 2.5 tm? -65.56 -39.87 92.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.057 176.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.489 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 8.6 tt -54.75 -33.53 61.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.043 176.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.25 79.27 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 110.317 174.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.924 HG21 ' HA ' ' A' ' 925' ' ' VAL . 1.4 m -56.03 -40.75 73.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.837 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.652 HG11 HD13 ' A' ' 984' ' ' ILE . 79.1 t -54.2 -32.0 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.681 173.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.748 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 24.9 t70 -68.06 -32.37 72.66 Favored 'General case' 0 C--O 1.219 -0.506 0 O-C-N 122.472 -0.143 . . . . 0.0 111.01 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.63 -53.0 63.13 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.78 1.276 . . . . 0.0 108.575 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.761 ' HG ' HG21 ' A' ' 980' ' ' THR . 26.7 t -65.42 -22.35 66.76 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.106 -1.406 . . . . 0.0 112.176 178.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.616 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.4 tt -59.73 -54.96 50.57 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.916 -177.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.748 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.8 Cg_endo -58.84 -22.42 62.18 Favored 'Trans proline' 0 C--N 1.357 1.007 0 CA-C-N 121.58 1.6 . . . . 0.0 111.133 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.575 HG12 ' HB2' ' A' 1046 ' ' MET . 60.0 t -74.35 -16.44 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.038 173.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.967 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -75.19 -41.37 3.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.42 -0.8 . . . . 0.0 112.409 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.967 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 23.7 Cg_exo -65.69 -27.07 52.91 Favored 'Trans proline' 0 C--N 1.361 1.219 0 CA-C-N 120.957 1.378 . . . . 0.0 110.354 171.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.06 -60.49 2.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.775 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.532 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 37.4 m -166.56 -34.2 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.78 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 1.5 t -63.38 -15.71 58.31 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -167.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.63 ' HA ' HG21 ' A' ' 984' ' ' ILE . 81.3 t60 -49.38 -21.03 0.78 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -71.29 -53.59 13.74 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.019 -0.673 . . . . 0.0 110.732 176.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 1.118 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.7 OUTLIER -76.75 -42.69 40.1 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.652 HD13 HG11 ' A' ' 969' ' ' VAL . 11.3 tp -59.38 -28.54 39.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.892 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -73.53 -40.95 63.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.533 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.592 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 20.4 ptp -64.87 -57.48 8.72 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.055 -172.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.16 -42.04 27.08 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -174.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.965 ' HA ' HD12 ' A' ' 991' ' ' LEU . 41.6 tt0 -57.35 -42.91 82.92 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.213 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -68.62 -31.02 69.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.366 0.603 . . . . 0.0 109.512 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.814 ' HG ' ' CG ' ' A' 1031 ' ' ASP . 3.1 tp -75.42 -31.81 60.5 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.673 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.965 HD12 ' HA ' ' A' ' 988' ' ' GLN . 44.1 mt -64.71 -49.79 69.49 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.229 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.412 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 26.8 t-20 -58.24 -40.39 81.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.535 -177.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.2 m -76.98 -35.33 57.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.465 -176.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.96 -31.48 12.15 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.049 ' HA ' HD23 ' A' 1028 ' ' LEU . 1.8 tm? -56.43 -37.64 70.5 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 162.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.568 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -60.42 -48.01 83.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.89 176.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.467 ' O ' ' HD3' ' A' 1001 ' ' LYS . 18.5 mt-10 -59.47 -37.09 77.31 Favored 'General case' 0 CA--C 1.504 -0.797 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.712 176.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.693 ' HG ' HG13 ' A' ' 955' ' ' VAL . 24.2 tp -68.63 -33.42 73.98 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.658 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.647 ' HB ' ' HE2' ' A' 1002 ' ' MET . 33.8 pt -79.26 -25.24 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.911 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.534 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.4 m-80 -79.73 -17.06 54.43 Favored 'General case' 0 C--O 1.211 -0.968 0 O-C-N 122.219 -0.3 . . . . 0.0 110.349 167.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.68 ' CG ' ' HA ' ' A' 1021 ' ' MET . 0.3 OUTLIER -86.49 -31.71 21.17 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.619 178.342 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.034 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -69.18 -36.28 77.17 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 167.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.781 ' O ' ' HB2' ' A' 1007 ' ' GLN . 59.9 tttp -62.44 -56.14 20.99 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.921 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' 1000 ' ' ASN . 29.1 mt -58.88 -43.86 91.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.33 -46.78 85.56 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.134 0.492 . . . . 0.0 110.23 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.24 -19.2 56.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.16 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.781 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -76.21 -44.82 36.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.453 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.508 ' O ' ' HG3' ' A' 1010 ' ' MET . 0.0 OUTLIER -71.77 -61.49 1.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.702 176.311 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.528 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 14.2 p 35.39 59.23 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.107 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.65 ' H ' ' HB2' ' A' 1014 ' ' GLN . 67.5 mtt -122.53 42.64 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.897 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.4 m 56.66 -94.6 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 176.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.9 m -82.4 -31.02 29.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.479 ' HB2' ' HB2' ' A' 1010 ' ' MET . 99.4 mt -72.14 -27.08 62.37 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.65 ' HB2' ' H ' ' A' 1010 ' ' MET . 1.2 tm0? -64.49 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.813 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -54.98 -43.76 73.81 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.2 tt0 -50.27 -43.82 53.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.443 174.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.414 ' CE2' HD21 ' A' 1004 ' ' LEU . 2.1 m-30 -77.97 -23.4 48.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.547 0.213 . . . . 0.0 110.681 -179.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.541 ' HB2' HE22 ' A' 1014 ' ' GLN . 39.3 ttpt -65.76 -37.0 85.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -71.29 -48.97 47.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.2 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' 1016 ' ' GLU . 70.7 mm-40 -52.13 -37.45 54.37 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 110.564 172.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.68 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 51.8 ttp -63.52 -50.21 70.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.75 176.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' 1018 ' ' LYS . 98.0 mt -61.9 -28.78 69.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.866 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 37.8 m -66.44 -36.73 83.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.489 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.559 ' HB3' ' HZ2' ' A' 1001 ' ' LYS . . . -78.57 -40.03 35.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.577 177.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.7 80.05 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.237 176.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.401 ' O ' HG22 ' A' 1030 ' ' VAL . 13.9 t60 -54.79 -51.59 65.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.441 176.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.632 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 1.049 HD23 ' HA ' ' A' ' 995' ' ' LEU . 12.3 tp -73.39 -42.6 61.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.218 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.25 84.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.401 HG22 ' O ' ' A' 1026 ' ' HIS . 54.7 t -67.03 -42.02 88.01 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.335 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.814 ' CG ' ' HG ' ' A' ' 990' ' ' LEU . 25.4 t0 -66.04 -32.29 73.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 176.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.12 -44.97 71.78 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 167.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.681 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 41.6 mtpt -70.84 -23.08 62.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.932 174.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.552 ' O ' HG23 ' A' 1038 ' ' VAL . 48.9 t30 -74.0 -43.79 56.8 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.819 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tp -79.85 -21.51 44.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.136 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.801 ' HA ' HG11 ' A' ' 929' ' ' VAL . 2.7 pp -72.08 -22.03 61.42 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.3 t70 -81.15 -48.08 12.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.506 168.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 1.118 HG12 ' HB3' ' A' ' 983' ' ' GLU . 18.4 t -47.89 -61.69 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.444 176.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.719 HG12 ' HB ' ' A' ' 925' ' ' VAL . 8.7 tt -89.75 -25.47 5.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 CA-C-N 114.351 -1.295 . . . . 0.0 112.061 -167.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.842 ' O ' ' HG3' ' A' 1043 ' ' ARG . 18.5 t70 -63.34 -33.36 75.35 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 118.983 -1.087 . . . . 0.0 109.032 162.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' 1037 ' ' ASP . 60.6 mt-30 -76.61 -26.86 55.42 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 118.735 -1.186 . . . . 0.0 109.149 171.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.629 ' HA ' ' HB2' ' A' 1045 ' ' LYS . . . -55.01 -50.31 69.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 117.913 0.324 . . . . 0.0 110.581 171.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.842 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -53.39 -41.33 65.81 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.815 178.671 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.613 ' N ' ' HD2' ' A' 1043 ' ' ARG . 31.8 tp -79.85 -29.82 40.17 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 122.006 -0.434 . . . . 0.0 111.395 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.78 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 7.6 mptt -55.05 -46.39 75.35 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.811 0.844 . . . . 0.0 110.173 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.575 ' HB2' HG12 ' A' ' 975' ' ' VAL . 24.8 ttt -62.23 -45.01 95.26 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.715 178.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.458 ' CD1' ' HB2' ' A' ' 920' ' ' ARG . 1.7 mp -67.99 -21.48 26.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.573 176.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' 1045 ' ' LYS . 32.5 t -66.63 -36.85 83.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 0.0 110.422 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -77.36 -34.68 55.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.225 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 32.5 t -88.78 -19.81 25.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.202 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 26.5 mtp180 68.48 152.95 0.13 Allowed Pre-proline 0 N--CA 1.466 0.344 0 C-N-CA 123.555 0.742 . . . . 0.0 111.932 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -72.93 -62.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.747 1.631 . . . . 0.0 109.879 165.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 11.4 p80 . . . . . 0 C--O 1.245 0.835 0 CA-C-N 115.087 -0.961 . . . . 0.0 108.748 170.162 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 1.107 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 120.729 0.3 . . . . 0.0 111.675 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.0 t -113.18 31.54 6.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.175 -175.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.485 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER 51.16 56.38 8.06 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.125 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.3 m-20 -47.26 -173.17 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.101 2.125 . . . . 0.0 112.932 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.591 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.8 tmtm? -40.27 -17.38 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.453 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.71 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -63.63 -53.23 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.767 174.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -77.55 -29.92 52.46 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 46.5 mt-10 -61.07 -60.73 3.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.278 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.457 HD22 HG22 ' A' ' 964' ' ' THR . 10.4 t-20 -67.91 -41.74 82.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.247 -171.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.859 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.1 p -60.09 -37.8 74.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.255 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.422 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 28.1 m -68.59 -31.17 70.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.099 0.476 . . . . 0.0 110.069 173.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.56 -32.21 68.54 Favored Glycine 0 CA--C 1.521 0.463 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.149 172.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.988 HD11 ' HB2' ' A' 1032 ' ' ALA . 3.4 tm? -61.54 -45.48 93.98 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.3 t -58.86 -42.71 86.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.209 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.5 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.0 mmtp -67.14 -21.61 65.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.365 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.16 -31.61 44.05 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.757 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.98 -13.91 11.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 119.679 -0.809 . . . . 0.0 109.04 172.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.606 HG12 ' O ' ' A' ' 933' ' ' VAL . 45.9 mm -68.21 -43.04 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 164.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 6.4 mm-40 -54.05 -45.17 71.58 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.298 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.784 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.0 tmt? -57.59 -42.18 82.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.251 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.533 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 24.2 m -69.04 -30.51 68.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.104 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.57 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 16.7 m -78.33 -43.14 28.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.3 mmtp -56.16 -42.08 76.46 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 113.335 -1.757 . . . . 0.0 111.759 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.714 HD12 ' HE2' ' A' 1018 ' ' LYS . 13.9 tt -73.82 -23.26 18.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.05 -177.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 34.4 mm-40 -53.67 -62.75 3.26 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.2 Cg_endo -99.95 -4.0 0.61 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.545 1.496 . . . . 0.0 114.515 -175.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.654 ' HB2' ' HG3' ' A' ' 950' ' ' GLU . . . -114.15 150.19 43.22 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -170.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 3.4 Cg_exo -82.84 -178.56 3.95 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.223 3.282 . . . . 0.0 112.961 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.7 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 85.7 Cg_exo -50.03 -33.16 33.65 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 123.624 2.883 . . . . 0.0 114.269 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.62 -29.74 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.493 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.654 ' HG3' ' HB2' ' A' ' 946' ' ' ALA . 63.9 mm-40 -97.45 -4.95 37.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.108 177.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.759 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 10.3 m-30 -56.34 -40.79 75.03 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 172.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.011 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.5 OUTLIER -77.13 -48.57 2.51 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.786 176.162 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.011 ' HD3' HG12 ' A' ' 952' ' ' VAL . 88.2 Cg_exo -52.56 -27.62 33.39 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 121.702 1.601 . . . . 0.0 114.6 172.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.784 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 19.9 ptp -74.2 -34.86 63.86 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.435 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.74 HG13 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -65.98 -26.76 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.745 171.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.713 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.2 tttm -53.24 -44.18 67.91 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 173.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 935' ' ' ALA . 2.9 mm-40 -55.49 -47.67 75.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.818 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.46 HG23 HD21 ' A' ' 998' ' ' LEU . 5.0 m -75.31 -30.77 23.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.33 -45.29 31.01 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.873 -174.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.65 -27.3 68.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.81 0.338 . . . . 0.0 110.341 172.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.454 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -61.59 -52.78 62.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.673 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.593 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 2.8 tm? -66.53 -31.24 71.84 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.559 0.618 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.546 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 50.6 ttm-85 -64.61 -48.07 76.27 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 121.784 -0.572 . . . . 0.0 111.074 173.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.457 HG22 HD22 ' A' ' 928' ' ' ASN . 39.7 m -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.262 0.553 . . . . 0.0 110.11 171.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 929' ' ' VAL . 0.5 OUTLIER -61.3 -39.42 90.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.668 176.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.546 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 52.4 tp -52.21 -32.9 38.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.646 174.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.72 98.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.435 0.636 . . . . 0.0 109.783 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.71 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.7 m -62.38 -38.66 90.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.241 172.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.658 HG12 HD13 ' A' ' 984' ' ' ILE . 93.6 t -54.05 -29.57 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.028 173.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.536 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 17.7 t70 -75.92 -25.59 56.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.798 -0.183 . . . . 0.0 111.041 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -66.92 -51.97 48.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.39 1.09 . . . . 0.0 109.163 171.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.405 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 33.3 p -63.7 -22.48 66.93 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.918 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.585 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 22.1 tp -54.45 -57.21 19.72 Favored Pre-proline 0 CA--C 1.54 0.579 0 CA-C-O 118.697 -0.668 . . . . 0.0 112.221 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.536 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 20.4 Cg_endo -64.16 -20.64 67.42 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.136 1.442 . . . . 0.0 111.167 173.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' 1042 ' ' ALA . 54.5 t -75.17 -18.81 16.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.116 175.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.684 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.9 pp -74.89 -44.36 4.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.882 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.684 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 21.7 Cg_endo -64.3 -26.95 63.71 Favored 'Trans proline' 0 C--N 1.364 1.353 0 CA-C-N 121.145 1.445 . . . . 0.0 110.64 172.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.37 -59.84 3.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.593 172.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.57 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 75.2 m -160.82 -49.01 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.695 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 2.0 t -56.59 -14.35 3.11 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -166.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.571 ' HA ' HG23 ' A' ' 984' ' ' ILE . 20.8 p-80 -51.26 -22.88 3.01 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -170.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.471 ' HA ' ' NE ' ' A' ' 982' ' ' ARG . 4.1 tpm_? -78.69 -51.18 10.19 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 110.026 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.831 ' HG3' HG23 ' A' 1038 ' ' VAL . 2.7 tp10 -73.34 -42.77 61.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.964 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.658 HD13 HG12 ' A' ' 969' ' ' VAL . 0.1 OUTLIER -55.79 -40.18 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -173.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -73.37 -31.18 63.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.792 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.603 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptp -63.89 -49.13 73.93 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.876 -178.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.599 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.18 -39.12 34.17 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 116.876 -0.147 . . . . 0.0 111.174 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 1.018 ' HA ' HD11 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -58.11 -47.6 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.799 -178.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -60.83 -35.83 77.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.543 0.687 . . . . 0.0 109.47 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.412 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.4 OUTLIER -68.25 -45.0 74.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.757 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.018 HD11 ' HA ' ' A' ' 988' ' ' GLN . 3.8 mt -58.76 -55.8 30.39 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.546 0.689 . . . . 0.0 110.507 -177.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -59.93 -33.1 71.45 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.821 -171.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 12.2 p -74.55 -38.49 62.72 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.663 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 51.3 m-20 -103.17 -28.63 11.81 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.087 -172.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.879 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.56 -42.83 93.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.217 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.594 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -64.15 -44.35 92.39 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.926 175.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.584 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 38.2 tt0 -53.41 -46.55 69.79 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.492 176.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.618 ' O ' ' HG2' ' A' 1002 ' ' MET . 28.2 tp -67.08 -38.55 85.95 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.898 -173.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.74 ' HA ' HG22 ' A' ' 955' ' ' VAL . 32.1 pt -61.05 -31.56 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.541 -178.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.619 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -95.32 -12.48 26.04 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.195 178.358 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.584 ' HG3' ' HG2' ' A' ' 997' ' ' GLU . 4.7 mmmm -84.74 -33.88 22.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.799 0.333 . . . . 0.0 110.453 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.679 ' SD ' ' HG3' ' A' 1021 ' ' MET . 72.7 mmm -74.4 -44.54 51.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 174.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' 1007 ' ' GLN . 47.1 tttp -53.47 -44.27 68.83 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.872 167.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.71 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 18.1 tp -58.71 -49.02 79.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 175.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.699 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -59.12 -40.28 84.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.561 0.696 . . . . 0.0 109.671 175.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.638 ' HG3' HG11 ' A' ' 952' ' ' VAL . 1.1 tm0? -64.49 -33.3 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.733 173.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.31 -24.36 50.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.123 -174.188 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.684 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.4 t80 -81.45 -64.28 1.22 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.603 174.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.57 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 8.0 p 37.13 40.63 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 O-C-N 124.695 1.247 . . . . 0.0 112.044 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.491 ' SD ' HD21 ' A' 1013 ' ' LEU . 53.7 ttm -80.89 9.06 6.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.83 -175.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' 1012 ' ' SER . 40.5 p 55.7 120.54 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.398 1.079 . . . . 0.0 112.839 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' 1011 ' ' THR . 51.4 m 73.39 -59.06 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.787 -177.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.491 HD21 ' SD ' ' A' 1010 ' ' MET . 29.2 tp -73.49 -7.79 53.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.455 0.645 . . . . 0.0 110.178 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.57 ' HG3' ' HA ' ' A' 1009 ' ' VAL . 1.1 tm0? -71.99 -17.4 62.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.51 0.672 . . . . 0.0 110.03 175.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.407 ' O ' ' HB3' ' A' 1018 ' ' LYS . 12.1 tp60 -61.01 -38.47 86.2 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.528 -173.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' 1013 ' ' LEU . 6.6 pt-20 -58.53 -36.15 73.42 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.401 -0.52 . . . . 0.0 111.406 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.71 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 0.7 OUTLIER -70.22 -23.36 62.92 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.416 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.714 ' HE2' HD12 ' A' ' 943' ' ' ILE . 64.6 tttm -80.33 -25.05 39.49 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.564 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -74.71 -54.14 7.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -53.1 -32.15 45.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.657 170.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.679 ' HG3' ' SD ' ' A' 1002 ' ' MET . 33.1 ttp -57.02 -49.0 77.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.591 175.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -64.02 -49.92 70.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -60.08 -37.57 80.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.147 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -73.78 -40.07 63.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.478 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.28 -34.85 79.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.614 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.541 ' O ' HG23 ' A' 1030 ' ' VAL . 76.4 t60 -74.28 -38.6 63.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.52 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.62 83.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 173.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.879 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -56.56 -46.04 80.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.007 176.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.552 ' O ' ' HG3' ' A' 1033 ' ' LYS . . . -55.67 -30.85 61.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.478 176.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' 1026 ' ' HIS . 57.7 t -71.94 -33.0 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.663 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 1.1 m-20 -51.77 -47.71 64.05 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.505 0.669 . . . . 0.0 109.3 172.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.988 ' HB2' HD11 ' A' ' 932' ' ' LEU . . . -66.46 -48.55 69.55 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.76 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.592 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 89.1 mttt -60.6 -39.67 88.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.716 -174.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.632 ' O ' HG21 ' A' 1038 ' ' VAL . 65.5 t30 -71.26 -36.95 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.034 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.753 ' O ' HG12 ' A' 1039 ' ' ILE . 20.4 tp -77.84 -29.4 50.5 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.544 -177.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.859 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -68.35 -24.86 64.86 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.428 ' O ' ' HG3' ' A' 1041 ' ' GLN . 38.6 t70 -81.8 -45.47 15.54 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.864 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.831 HG23 ' HG3' ' A' ' 983' ' ' GLU . 24.5 t -53.89 -62.16 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.806 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.753 HG12 ' O ' ' A' 1035 ' ' LEU . 8.2 pt -84.0 -27.46 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -173.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.607 ' O ' ' HG3' ' A' 1043 ' ' ARG . 26.5 t70 -61.06 -30.8 70.54 Favored 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 118.145 -1.422 . . . . 0.0 108.893 163.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.53 ' O ' ' HD3' ' A' 1045 ' ' LYS . 73.6 mt-30 -79.76 -24.04 41.81 Favored 'General case' 0 C--O 1.203 -1.394 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.677 169.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.623 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -58.22 -52.63 64.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.331 0.586 . . . . 0.0 109.822 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 1.107 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 6.5 ppt_? -57.3 -32.09 66.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.677 176.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.423 ' N ' ' HD2' ' A' 1043 ' ' ARG . 51.7 tp -78.95 -29.68 44.16 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.177 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.695 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 12.0 mptt -61.52 -43.23 99.23 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.684 0.793 . . . . 0.0 110.167 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.1 ttt -64.33 -35.03 79.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.567 176.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.53 ' O ' ' HG2' ' A' 1051 ' ' ARG . 45.6 mm -70.72 -43.54 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.914 174.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.5 m -51.74 -33.01 32.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.014 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.411 ' HA ' ' OE1' ' A' 1049 ' ' GLN . 6.8 tp60 -83.46 -29.65 27.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.682 0.277 . . . . 0.0 111.042 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 3.1 p -88.15 -10.83 48.69 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.53 ' HG2' ' O ' ' A' 1047 ' ' ILE . 13.2 ptm180 -133.29 104.74 12.3 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 121.188 0.518 . . . . 0.0 110.191 173.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 20.5 Cg_exo -67.05 -16.66 49.9 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 123.107 2.538 . . . . 0.0 112.686 -178.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 10.1 p80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.974 178.887 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.496 ' C ' ' H ' ' A' ' 922' ' ' ASN . 25.0 tpt180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 63.9 m 68.92 -1.71 1.97 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.563 0.697 . . . . 0.0 110.626 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.864 ' OD1' ' HA ' ' A' 1040 ' ' ASP . 0.4 OUTLIER 64.77 74.66 0.39 Allowed 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 114.364 -1.289 . . . . 0.0 113.952 174.436 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.535 ' CG ' ' H ' ' A' ' 924' ' ' LYS . 37.1 t70 -48.88 -173.77 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 111.907 -2.406 . . . . 0.0 113.277 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.641 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.0 tmtp? -41.08 -14.52 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.617 1.167 . . . . 0.0 112.88 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.756 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.5 m -63.6 -51.58 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 C-N-CA 122.959 0.503 . . . . 0.0 112.042 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.751 ' HB2' ' OD1' ' A' ' 922' ' ' ASN . 49.0 t80 -75.49 -34.12 60.85 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.257 1.027 . . . . 0.0 108.384 -178.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 40.5 mt-10 -64.94 -58.7 5.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 113.475 -1.693 . . . . 0.0 112.59 -176.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.641 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 3.6 t-20 -73.36 -31.02 63.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -171.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.711 ' CG2' HD13 ' A' 1039 ' ' ILE . 22.7 t -68.28 -35.86 72.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.793 176.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 90.5 m -56.86 -25.31 56.29 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.553 0.692 . . . . 0.0 109.969 163.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . 0.46 ' HA2' ' HG2' ' A' ' 934' ' ' LYS . . . -71.84 -26.88 71.76 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.526 176.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.72 HD12 HD11 ' A' ' 965' ' ' LEU . 6.4 tt -61.93 -41.35 97.84 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 172.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.636 ' O ' HG12 ' A' ' 937' ' ' ILE . 45.0 t -61.06 -45.2 99.03 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.979 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.487 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.3 mmpt? -54.67 -44.49 73.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.551 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.682 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.01 -28.65 60.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.7 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.577 ' HA ' HG13 ' A' ' 958' ' ' VAL . 8.8 p -77.62 -18.38 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 119.869 -0.732 . . . . 0.0 109.629 174.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.636 HG12 ' O ' ' A' ' 933' ' ' VAL . 34.8 mm -67.95 -26.08 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 169.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.545 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 35.5 mm-40 -64.9 -42.47 94.74 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.322 173.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.707 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.6 ptt? -55.64 -42.14 74.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.331 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.476 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 9.7 p -75.07 -35.22 61.85 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 12.1 p -77.6 -48.95 15.63 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.264 0.554 . . . . 0.0 111.067 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.462 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -68.64 -22.19 64.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.386 -176.169 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.672 ' HA ' ' HB2' ' A' ' 946' ' ' ALA . 10.4 tp -79.89 -22.75 11.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.669 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.68 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 33.7 mm-40 -49.3 -54.97 24.44 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.826 -0.17 . . . . 0.0 110.96 175.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 76.2 Cg_endo -95.24 30.22 0.21 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.614 1.543 . . . . 0.0 113.2 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.861 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -133.11 153.26 80.76 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -173.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.652 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.9 Cg_endo -92.88 -175.23 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.025 3.15 . . . . 0.0 111.968 174.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.904 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 9.7 Cg_endo -53.17 -30.53 51.01 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.875 2.384 . . . . 0.0 112.836 176.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -57.66 -29.52 64.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.061 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.861 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 48.9 mm-40 -102.02 0.86 35.76 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.088 0.243 . . . . 0.0 111.198 175.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.904 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 1.7 m-85 -59.26 -44.03 92.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -74.78 -48.09 4.93 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.392 176.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.7 Cg_exo -55.77 -23.63 42.56 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 121.696 1.598 . . . . 0.0 114.596 172.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.728 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 22.2 ptt? -73.32 -36.44 66.23 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.114 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 1.004 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -66.63 -27.22 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.085 172.763 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 83.1 tttt -55.15 -42.1 72.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 175.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.86 -47.44 71.0 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.462 173.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.59 HG22 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -68.47 -23.59 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.223 176.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.535 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -66.26 -42.69 94.01 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.475 HD22 ' HD2' ' A' ' 963' ' ' ARG . 84.5 mt -70.27 -10.27 58.43 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.27 0.557 . . . . 0.0 110.362 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.709 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -78.83 -56.24 4.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.925 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.667 HD12 ' HB3' ' A' ' 991' ' ' LEU . 2.6 tt -66.67 -29.06 68.99 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.285 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.475 ' HD2' HD22 ' A' ' 960' ' ' LEU . 54.9 mtt-85 -59.56 -61.42 2.63 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.069 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 5.3 m -56.1 -30.66 62.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.059 0.457 . . . . 0.0 110.95 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.72 HD11 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -67.12 -41.43 86.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.912 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -52.91 -35.48 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.377 174.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -60.91 -49.4 77.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.142 0.496 . . . . 0.0 110.068 175.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.756 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.2 m -58.24 -42.86 87.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.775 171.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.717 HG12 HD12 ' A' ' 984' ' ' ILE . 53.3 t -54.42 -30.96 22.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.422 0.153 . . . . 0.0 111.168 174.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.599 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 19.3 t70 -71.62 -26.09 62.43 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 177.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.529 ' O ' HG22 ' A' ' 975' ' ' VAL . 39.1 mm-40 -69.09 -44.89 71.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.383 1.087 . . . . 0.0 108.889 169.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.591 ' OG ' HG23 ' A' ' 980' ' ' THR . 33.4 t -66.36 -24.56 66.52 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.857 178.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.5 OUTLIER -60.71 -52.98 68.73 Favored Pre-proline 0 C--O 1.214 -0.783 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.639 -177.264 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.606 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 10.5 Cg_endo -58.71 -26.82 81.29 Favored 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.676 1.634 . . . . 0.0 111.373 170.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.58 HG21 ' HE1' ' A' 1046 ' ' MET . 2.1 t -75.82 -15.9 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.527 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.995 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -64.53 -52.68 50.73 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.695 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.634 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 31.5 Cg_exo -62.71 -30.26 78.25 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 121.409 1.406 . . . . 0.0 111.084 175.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.27 -57.33 10.8 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.173 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.776 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 17.1 m -165.49 -36.36 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.242 0.544 . . . . 0.0 112.194 -174.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.791 HG21 ' HB ' ' A' ' 984' ' ' ILE . 70.7 m -56.18 -22.71 30.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -173.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.995 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 24.7 p-80 -51.05 -30.02 14.45 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.054 0.843 . . . . 0.0 112.808 -172.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 40.3 mtm105 -62.28 -55.39 28.7 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.927 -0.709 . . . . 0.0 111.532 173.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.77 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.47 -47.29 23.44 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.471 -0.491 . . . . 0.0 112.198 -174.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.791 ' HB ' HG21 ' A' ' 980' ' ' THR . 13.0 tt -55.27 -37.97 45.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.429 -172.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 2.9 pp20? -73.28 -31.7 64.22 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.181 -178.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.727 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 18.0 ptp -62.54 -56.76 14.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.218 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.11 -33.16 44.62 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.804 ' HA ' HD11 ' A' ' 991' ' ' LEU . 57.7 tt0 -60.43 -44.69 95.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.306 -178.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.564 ' HG3' ' O ' ' A' ' 985' ' ' GLU . 28.0 mtmm -64.73 -34.04 77.39 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.525 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 3.0 tp -64.12 -46.31 84.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.495 177.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.02 HD13 ' HG ' ' A' 1035 ' ' LEU . 13.2 mt -54.51 -60.14 3.76 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.075 0.464 . . . . 0.0 110.568 175.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -50.99 -43.03 60.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.241 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.561 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 42.0 t -62.35 -56.94 13.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.957 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.433 ' O ' HD23 ' A' ' 998' ' ' LEU . 1.8 m-20 -83.15 -42.89 16.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -168.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.895 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.8 OUTLIER -53.1 -55.1 26.55 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.812 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.679 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -54.75 -43.82 73.04 Favored 'General case' 0 N--CA 1.46 0.067 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 174.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.734 ' O ' ' HG2' ' A' 1001 ' ' LYS . 36.5 mt-10 -54.24 -43.29 70.77 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.241 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.717 ' O ' ' HG2' ' A' 1002 ' ' MET . 4.1 mm? -63.64 -36.47 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.049 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.869 ' HA ' HG13 ' A' ' 955' ' ' VAL . 11.1 pt -71.04 -7.87 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 119.99 -0.684 . . . . 0.0 109.972 -177.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.721 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 13.7 m-80 -113.13 -15.3 12.8 Favored 'General case' 0 C--O 1.207 -1.145 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.734 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 21.8 mmmt -73.75 -32.73 63.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.004 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 12.3 mmt -78.55 -42.02 30.46 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.721 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 16.1 tppt? -55.4 -45.18 76.66 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.206 169.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.408 ' HA ' HD21 ' A' 1004 ' ' LEU . 14.6 mt -61.51 -48.21 82.1 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.687 0.617 . . . . 0.0 112.286 175.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.78 -44.1 86.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.169 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.48 -16.56 59.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.841 178.12 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.678 ' HB2' ' O ' ' A' 1003 ' ' LYS . 7.6 tp-100 -81.42 -36.72 29.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.315 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.578 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.2 t80 -73.05 -66.44 0.68 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.332 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 9.4 p 38.76 37.18 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 124.663 1.227 . . . . 0.0 112.129 178.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 24.0 ttt -90.4 106.34 18.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.503 -174.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 46.7 p 44.47 -95.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 O-C-N 124.339 1.025 . . . . 0.0 112.758 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 50.5 m -135.68 9.86 3.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.413 0.625 . . . . 0.0 109.967 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.12 -5.53 59.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.02 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -27.15 62.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.618 177.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.96 -31.6 65.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.549 ' O ' ' HG2' ' A' 1020 ' ' GLN . 34.8 tt0 -54.46 -54.31 42.63 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.849 170.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.578 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-85 -60.21 -35.88 76.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.007 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -62.12 -36.34 81.48 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.597 0.237 . . . . 0.0 110.974 171.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.485 ' HB3' ' O ' ' A' 1016 ' ' GLU . 14.5 tppt? -63.28 -54.9 30.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.041 0.448 . . . . 0.0 110.063 175.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' 1016 ' ' GLU . 6.8 mm-40 -51.3 -37.77 49.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.212 173.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1021 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -65.69 -41.8 91.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.122 177.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 69.8 mt -60.5 -44.25 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 111.408 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.8 m -66.04 -46.7 76.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.232 0.539 . . . . 0.0 110.229 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.63 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -62.28 -43.41 98.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.191 178.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.475 ' N ' HD13 ' A' ' 998' ' ' LEU . . . -60.39 -31.57 70.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.775 0.321 . . . . 0.0 111.009 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.597 ' O ' HG22 ' A' 1030 ' ' VAL . 12.2 t-80 -75.76 -35.69 60.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.575 -0.45 . . . . 0.0 109.847 176.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.39 94.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.895 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.8 tt -56.29 -55.82 28.58 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.605 0.717 . . . . 0.0 111.004 171.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -52.98 -28.79 25.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.005 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' 1026 ' ' HIS . 77.4 t -74.11 -41.64 51.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 119.619 -0.229 . . . . 0.0 111.519 173.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.736 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -61.53 -46.93 87.85 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.09 177.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.525 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -53.77 -40.46 66.25 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.79 169.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.531 ' O ' ' HG ' ' A' 1036 ' ' LEU . 88.6 tttt -77.37 -35.04 54.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.424 0.631 . . . . 0.0 110.246 -172.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.444 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -75.41 -45.57 38.1 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.988 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 1.02 ' HG ' HD13 ' A' ' 991' ' ' LEU . 3.4 tm? -67.99 -33.68 75.09 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.96 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.611 ' O ' ' HB2' ' A' 1040 ' ' ASP . 4.2 pp -64.74 -29.34 70.32 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.451 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 20.8 t70 -84.98 -37.67 20.17 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.887 0.742 . . . . 0.0 109.511 178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.77 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 5.7 t -52.88 -52.97 23.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.654 172.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.805 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 24.4 pt -90.48 -22.77 6.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.864 ' HA ' ' OD1' ' A' ' 922' ' ' ASN . 6.2 t70 -44.81 -49.26 10.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 157.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 28.3 mt-30 -78.44 -27.33 46.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.481 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.805 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.68 -56.12 22.53 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 118.333 0.515 . . . . 0.0 111.46 175.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.603 ' HB2' HG23 ' A' ' 925' ' ' VAL . 0.1 OUTLIER -57.82 -32.3 67.45 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.336 176.49 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.87 -13.1 59.99 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.762 174.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.776 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.7 mmtp -73.24 -35.47 66.26 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.58 ' HE1' HG21 ' A' ' 975' ' ' VAL . 59.8 ttm -66.42 -40.65 89.66 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.669 173.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.03 -35.0 62.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.794 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 22.3 t -70.12 -33.87 72.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.02 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -78.46 -31.49 47.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.743 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 49.4 m -81.71 -34.09 30.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.356 175.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 73.02 133.39 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.347 0 C-N-CA 123.823 0.849 . . . . 0.0 111.392 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.38 147.23 86.39 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.976 2.45 . . . . 0.0 112.332 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 13.7 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.226 -178.571 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.657 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 2.1 tpm_? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 35.2 t 73.53 -0.24 3.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.035 0.534 . . . . 0.0 111.668 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.4 OUTLIER 52.54 68.75 0.78 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-O 121.598 0.714 . . . . 0.0 111.247 175.12 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 925' ' ' VAL . 45.3 t0 -45.1 -171.78 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 112.105 -2.316 . . . . 0.0 112.687 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.637 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.3 tmtp? -34.9 -21.44 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.392 1.077 . . . . 0.0 113.007 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.832 HG23 ' HB2' ' A' 1043 ' ' ARG . 0.5 OUTLIER -56.36 -56.17 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 172.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -78.02 -30.54 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.156 0.979 . . . . 0.0 108.527 -177.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.637 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 86.4 mt-10 -60.31 -50.92 71.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.978 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.483 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 32.3 t-20 -66.1 -44.46 84.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.346 -174.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.571 ' HB ' ' HB3' ' A' 1036 ' ' LEU . 4.1 t -62.44 -30.97 50.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.057 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.533 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 56.4 m -64.05 -34.77 78.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.881 0.848 . . . . 0.0 109.146 171.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.95 -28.0 62.94 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.85 172.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.967 HD13 HD12 ' A' ' 965' ' ' LEU . 3.7 tt -66.92 -49.17 66.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 117.455 0.627 . . . . 0.0 109.745 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.547 ' O ' HG12 ' A' ' 937' ' ' ILE . 3.4 m -63.01 -32.24 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.895 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.533 ' HD2' ' O ' ' A' ' 930' ' ' THR . 1.3 mpmm? -65.07 -28.41 69.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.854 0.359 . . . . 0.0 110.994 174.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.624 ' CB ' ' HB3' ' A' ' 961' ' ' ALA . . . -82.14 -26.03 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 0.0 111.265 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.543 HG13 ' HA ' ' A' ' 933' ' ' VAL . 9.7 p -80.81 -10.43 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.124 172.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.7 mm -71.86 -36.87 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 166.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.536 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 41.2 mt-10 -57.74 -45.05 86.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.668 170.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.547 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.2 -45.2 91.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.682 176.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.72 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.9 t -64.27 -37.98 89.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.308 -177.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.542 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.5 p -77.11 -38.87 51.3 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 -176.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.611 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.7 mmtp -52.87 -49.96 64.79 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.683 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.724 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.2 tt -71.1 -23.74 23.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.799 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 84.7 mm-40 -59.38 -64.75 2.6 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -175.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.799 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -101.29 5.55 0.59 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.667 1.578 . . . . 0.0 113.832 -174.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -110.62 157.22 38.98 Favored Pre-proline 0 C--N 1.323 -0.572 0 C-N-CA 120.627 -0.429 . . . . 0.0 112.098 -173.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.99 176.37 9.46 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.417 2.744 . . . . 0.0 112.237 177.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.728 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.7 Cg_exo -53.29 -24.93 28.72 Favored 'Trans proline' 0 C--O 1.245 0.863 0 C-N-CA 123.318 2.679 . . . . 0.0 113.289 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -54.55 -31.27 56.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.097 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.546 ' OE1' ' HE2' ' A' ' 942' ' ' LYS . 10.7 mm-40 -100.96 1.18 39.48 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.323 178.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.728 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 13.7 m-30 -64.27 -39.01 93.07 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 172.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.044 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -73.18 -51.22 6.08 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.591 174.856 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.967 ' HD3' HG12 ' A' ' 952' ' ' VAL . 84.3 Cg_exo -51.62 -36.86 62.24 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.157 1.905 . . . . 0.0 114.742 172.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.724 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 26.4 ptt? -62.71 -46.99 85.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.394 0.616 . . . . 0.0 110.054 -177.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.594 ' O ' HG21 ' A' ' 958' ' ' VAL . 89.4 t -68.21 -26.55 34.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 173.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 87.3 tttt -58.75 -38.11 77.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 6.1 mm-40 -55.37 -46.88 76.45 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.855 174.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.594 HG21 ' O ' ' A' ' 955' ' ' VAL . 2.5 m -74.24 -22.35 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 O-C-N 122.202 -0.311 . . . . 0.0 111.829 177.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.512 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.48 -44.0 66.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.135 -1.031 . . . . 0.0 111.479 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.42 -27.78 69.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.588 0.232 . . . . 0.0 110.768 171.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.676 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -58.62 -56.91 16.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.218 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 991' ' ' LEU . 5.1 tt -63.03 -36.57 84.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.191 -0.204 . . . . 0.0 111.057 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 46.1 ttt180 -59.85 -53.47 57.51 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 176.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.8 m -55.92 -40.9 73.76 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.848 0.832 . . . . 0.0 109.914 174.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.967 HD12 HD13 ' A' ' 932' ' ' LEU . 2.2 tt -60.78 -29.51 69.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.851 176.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.1 tp -68.03 -29.56 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.549 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.33 -38.33 90.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.352 0.596 . . . . 0.0 109.668 173.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.71 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.3 m -71.2 -33.69 70.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.101 174.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 965' ' ' LEU . 78.6 t -55.12 -30.99 24.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.537 171.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.476 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.6 t70 -77.87 -26.23 49.12 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 177.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.544 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.5 mm-40 -65.91 -54.25 28.93 Favored 'General case' 0 C--O 1.25 1.079 0 CA-C-O 123.344 1.545 . . . . 0.0 108.514 170.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 46.6 t -62.84 -26.94 69.0 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.657 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.785 ' HA ' HD12 ' A' ' 976' ' ' LEU . 4.9 tt -57.33 -52.99 70.09 Favored Pre-proline 0 N--CA 1.472 0.674 0 CA-C-O 118.597 -0.716 . . . . 0.0 112.421 -174.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 51.7 Cg_exo -55.19 -30.75 72.82 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.178 1.456 . . . . 0.0 110.541 170.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.562 HG11 ' HG1' ' A' ' 980' ' ' THR . 2.6 t -77.05 -13.71 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.618 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.855 ' HG ' HG23 ' A' ' 984' ' ' ILE . 5.8 mp -61.72 -64.45 3.07 Favored Pre-proline 0 N--CA 1.472 0.66 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.8 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.71 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 17.3 Cg_endo -58.21 -28.19 83.24 Favored 'Trans proline' 0 C--N 1.364 1.361 0 C-N-CA 121.505 1.47 . . . . 0.0 111.291 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.619 ' O ' ' HG3' ' A' 1049 ' ' GLN . . . -59.52 -52.2 66.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.513 173.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 1.071 ' HB3' ' HB3' ' A' 1045 ' ' LYS . 3.5 t -171.58 -33.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.034 0.445 . . . . 0.0 112.044 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.973 HG21 ' HB ' ' A' ' 984' ' ' ILE . 18.0 m -63.81 -22.19 66.79 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -172.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.452 ' HA ' HG21 ' A' ' 984' ' ' ILE . 15.8 t-80 -53.21 -21.56 5.38 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -175.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -76.1 -54.78 6.33 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.162 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.743 ' CG ' HG22 ' A' 1038 ' ' VAL . 3.4 tp10 -74.49 -43.14 57.35 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.426 -0.509 . . . . 0.0 111.374 -178.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.973 ' HB ' HG21 ' A' ' 980' ' ' THR . 0.2 OUTLIER -59.45 -37.71 71.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -174.527 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.27 -43.88 83.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.543 174.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.677 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.8 ptm -63.02 -47.91 81.04 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.143 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.874 ' HB3' HG21 ' A' 1038 ' ' VAL . . . -79.44 -43.54 23.09 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.829 ' HA ' HD11 ' A' ' 991' ' ' LEU . 61.5 tt0 -60.27 -45.98 91.42 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.974 -0.291 . . . . 0.0 111.544 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -66.54 -31.02 71.47 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.93 -40.39 91.36 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.359 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.012 HD13 HD23 ' A' 1035 ' ' LEU . 18.5 mt -58.07 -56.28 24.13 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.519 0.676 . . . . 0.0 110.557 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.99 -31.8 63.36 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.75 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.5 m -76.07 -36.34 59.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.838 -177.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -102.55 -31.47 10.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.06 -174.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.84 ' HA ' HD13 ' A' 1028 ' ' LEU . 1.5 tm? -59.41 -41.25 89.06 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 168.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -63.61 -44.63 93.37 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.152 178.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.507 ' O ' ' HD3' ' A' 1001 ' ' LYS . 19.2 mm-40 -53.14 -43.33 66.9 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.681 173.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.845 HD13 HD11 ' A' 1028 ' ' LEU . 2.4 mt -67.26 -28.97 68.47 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.74 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.709 HG23 ' HE1' ' A' 1002 ' ' MET . 44.0 mm -66.23 -43.21 91.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.837 177.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.2 m-20 -79.31 -15.2 58.31 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.853 177.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -87.17 -36.83 17.81 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.204 0.315 . . . . 0.0 111.371 178.464 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.044 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -65.71 -39.48 91.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 169.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 58.9 tttm -62.56 -53.31 56.54 Favored 'General case' 0 C--O 1.204 -1.322 0 CA-C-N 114.021 -1.445 . . . . 0.0 108.511 174.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.595 ' HG ' ' HB3' ' A' 1017 ' ' TYR . 21.5 tp -49.29 -56.38 9.64 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.352 1.061 . . . . 0.0 113.489 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.84 -45.85 89.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.479 0.657 . . . . 0.0 110.18 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.467 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.4 pp0? -76.54 -11.06 59.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.086 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -81.27 -40.31 23.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.267 -176.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.552 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 11.7 m-85 -115.68 22.37 13.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.807 177.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.656 HG22 ' HG2' ' A' ' 948' ' ' PRO . 1.5 p -28.93 116.93 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 11.3 tpt 81.34 164.22 0.15 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.779 165.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.3 m 76.41 74.85 0.08 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.305 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 65.1 m 64.25 -70.33 0.08 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 171.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' 1013 ' ' LEU . 3.6 mm? -61.67 -15.59 41.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -169.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.49 ' HA ' ' HD2' ' A' 1017 ' ' TYR . 0.7 OUTLIER -52.93 -44.8 67.29 Favored 'General case' 0 C--O 1.219 -0.525 0 O-C-N 123.05 0.219 . . . . 0.0 110.495 -176.63 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -55.07 -34.83 63.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.541 ' HG2' ' CE1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -48.05 -50.31 28.43 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.825 0.821 . . . . 0.0 110.882 168.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.595 ' HB3' ' HG ' ' A' 1004 ' ' LEU . 14.5 m-85 -78.98 -20.06 50.08 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.668 -175.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.492 ' O ' ' HG ' ' A' 1022 ' ' LEU . 19.0 ttmm -72.34 -33.13 67.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.211 169.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.42 ' HB3' ' HE3' ' A' 1019 ' ' LYS . 20.6 mmmt -74.42 -56.67 4.59 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.566 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' 1016 ' ' GLU . 44.2 mt-30 -50.8 -31.7 17.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.471 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 14.9 tmm? -67.85 -45.95 73.14 Favored 'General case' 0 C--O 1.23 0.06 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.266 175.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' 1018 ' ' LYS . 95.8 mt -60.54 -40.14 90.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.874 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 24.8 m -62.59 -34.17 76.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 0.0 110.582 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.42 -42.04 31.23 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.069 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.496 ' HA ' HD12 ' A' ' 998' ' ' LEU . . . -61.83 -38.43 88.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.05 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.597 ' O ' HG22 ' A' 1030 ' ' VAL . 19.0 t-80 -69.08 -47.92 64.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.375 178.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.14 -34.94 75.8 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.441 0.463 . . . . 0.0 110.427 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.845 HD11 HD13 ' A' ' 998' ' ' LEU . 0.7 OUTLIER -63.12 -50.05 72.0 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.685 0.755 . . . . 0.0 110.385 174.688 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.56 -37.53 68.13 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.053 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' 1026 ' ' HIS . 57.2 t -67.57 -30.57 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.695 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -75.14 -39.35 60.55 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.711 -0.795 . . . . 0.0 109.029 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.406 ' HB2' HD21 ' A' ' 932' ' ' LEU . . . -62.19 -53.16 59.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.19 172.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.508 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 27.0 mtpp -61.89 -39.73 92.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.814 -177.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.629 ' O ' HG23 ' A' 1038 ' ' VAL . 7.4 t30 -68.55 -38.01 80.43 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.111 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 1.012 HD23 HD13 ' A' ' 991' ' ' LEU . 15.4 tp -78.36 -26.08 46.56 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.09 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.571 ' HB3' ' HB ' ' A' ' 929' ' ' VAL . 4.4 pp -74.11 -21.57 59.84 Favored 'General case' 0 C--O 1.211 -0.944 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' A' 1041 ' ' GLN . 3.9 m-20 -82.23 -46.53 13.59 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 123.967 0.792 . . . . 0.0 109.163 170.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.874 HG21 ' HB3' ' A' ' 987' ' ' ALA . 29.0 t -50.6 -57.07 2.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.482 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.794 ' CG2' ' HB ' ' A' ' 925' ' ' VAL . 17.2 mt -73.36 -35.97 47.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.95 -177.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' 1036 ' ' LEU . 5.0 t70 -50.98 -45.46 60.96 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 166.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.634 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.9 mt-30 -72.57 -29.34 63.45 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.09 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.591 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -54.03 -58.03 8.82 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 121.043 0.449 . . . . 0.0 111.777 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.832 ' HB2' HG23 ' A' ' 925' ' ' VAL . 0.6 OUTLIER -59.51 -28.83 67.41 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.356 177.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 40.1 tp -77.42 -25.82 51.1 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.451 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 1.071 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 3.6 mmpm? -63.33 -33.59 75.86 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.855 0.836 . . . . 0.0 109.091 175.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.9 ttt -64.72 -43.6 92.91 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.301 -1.318 . . . . 0.0 109.275 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.484 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.1 mm -60.85 -43.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.0 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' 1045 ' ' LYS . 66.3 m -53.97 -29.61 43.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.219 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.619 ' HG3' ' O ' ' A' ' 978' ' ' ALA . 26.5 mm-40 -108.95 -28.46 9.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -176.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 35.3 t -72.98 -21.82 60.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.842 -0.163 . . . . 0.0 111.116 -177.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' A' 1051 ' ' ARG . 12.2 tpt180 -127.66 108.26 20.67 Favored Pre-proline 0 C--N 1.328 -0.356 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.386 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.39 -39.69 5.06 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.808 2.339 . . . . 0.0 111.195 173.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 26.5 t60 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.532 -0.746 . . . . 0.0 109.67 176.89 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.938 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 38.2 m 74.27 22.75 2.17 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.888 0.742 . . . . 0.0 111.034 -174.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.938 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 44.02 55.65 5.2 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.999 176.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 925' ' ' VAL . 14.0 m-20 -46.52 -175.15 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.487 0 O-C-N 125.121 1.513 . . . . 0.0 112.582 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.528 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 5.4 tmtp? -33.06 -24.76 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.667 1.187 . . . . 0.0 113.243 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.789 HG22 ' HB2' ' A' 1043 ' ' ARG . 4.9 m -61.85 -53.38 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-O 119.194 -0.431 . . . . 0.0 112.081 175.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.61 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 71.2 t80 -78.4 -27.29 46.69 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.488 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.5 mt-10 -64.97 -61.12 2.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.901 -178.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.528 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -70.02 -34.53 73.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.11 -172.726 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.937 ' HB ' HD11 ' A' 1039 ' ' ILE . 12.7 p -62.36 -34.76 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.816 175.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.531 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -68.1 -35.36 78.03 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.94 -28.39 63.46 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.416 172.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 5.5 tt -63.39 -42.93 98.83 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 175.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.575 ' O ' HG12 ' A' ' 937' ' ' ILE . 42.4 t -63.97 -38.12 81.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.263 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.547 ' HA ' ' HE2' ' A' ' 934' ' ' LYS . 10.5 mmpt? -65.11 -33.95 77.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.992 0.425 . . . . 0.0 110.469 177.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.722 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . . . -76.2 -26.13 55.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.338 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.644 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -83.38 -14.14 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.673 173.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.575 HG12 ' O ' ' A' ' 933' ' ' VAL . 39.7 mm -70.08 -35.79 65.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 166.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.614 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 46.5 mt-10 -54.35 -43.65 71.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.365 170.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.619 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.2 ttp -58.46 -43.59 88.93 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.596 0.56 . . . . 0.0 110.356 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.572 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 16.7 m -65.6 -37.18 85.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.093 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.489 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.6 m -77.3 -43.06 34.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -177.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.681 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.4 mmtm -49.94 -57.65 7.05 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.601 -1.636 . . . . 0.0 111.259 176.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.88 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 12.9 tt -62.5 -29.27 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.767 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.5 mt-30 -50.29 -60.69 4.8 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.767 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 18.1 Cg_endo -93.37 0.94 3.44 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.499 1.466 . . . . 0.0 113.879 177.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.882 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -90.16 148.43 39.3 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.57 175.34 6.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.902 3.068 . . . . 0.0 110.064 165.153 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.644 ' HG3' HG21 ' A' 1009 ' ' VAL . 9.9 Cg_endo -51.87 -31.01 40.94 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.742 2.295 . . . . 0.0 112.511 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.54 -33.27 67.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.081 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.882 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 1.3 mp0 -98.73 -0.27 43.11 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 122.953 0.158 . . . . 0.0 111.297 175.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.705 ' O ' ' HG2' ' A' ' 954' ' ' MET . 10.1 m-30 -65.55 -37.84 87.88 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 175.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.046 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -78.42 -45.16 2.08 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.163 173.447 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.046 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.4 Cg_exo -53.81 -28.43 47.94 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.829 1.686 . . . . 0.0 113.999 170.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.912 ' HE3' ' HE2' ' A' 1002 ' ' MET . 16.6 ptt? -72.87 -37.89 67.21 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.465 178.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.78 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -64.82 -26.49 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.702 171.494 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.679 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 55.7 tttt -57.0 -40.77 77.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -55.67 -46.17 77.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.49 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 936' ' ' VAL . 1.6 m -72.77 -22.7 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 120.798 0.332 . . . . 0.0 111.179 176.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.528 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.28 -44.27 66.56 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.175 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.78 -24.07 67.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.948 172.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.722 ' HB1' ' HB3' ' A' ' 935' ' ' ALA . . . -61.1 -57.82 10.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.324 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.665 ' HB2' HD11 ' A' ' 995' ' ' LEU . 22.8 tp -68.71 -34.42 75.61 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.637 -0.425 . . . . 0.0 112.016 178.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 959' ' ' GLY . 75.1 mtp180 -59.57 -55.23 37.1 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.772 -0.58 . . . . 0.0 112.437 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.427 HG22 ' OD1' ' A' ' 928' ' ' ASN . 14.7 m -57.88 -34.7 70.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.584 0.707 . . . . 0.0 110.242 174.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.657 HD11 HD13 ' A' ' 962' ' ' LEU . 3.0 tm? -63.81 -29.0 70.24 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.235 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.463 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 0.2 OUTLIER -66.94 -28.16 68.06 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.687 -178.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.06 89.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.381 0.61 . . . . 0.0 109.836 172.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.738 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.3 m -58.55 -39.68 80.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.61 172.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.522 HG12 HD12 ' A' ' 984' ' ' ILE . 72.7 t -54.07 -30.55 20.22 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.307 174.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.485 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.2 t70 -74.65 -24.06 58.77 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.6 mm-40 -71.91 -51.22 23.28 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.83 1.3 . . . . 0.0 109.135 169.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.661 ' HG ' HG22 ' A' ' 980' ' ' THR . 30.9 t -65.45 -24.56 67.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.803 -1.544 . . . . 0.0 111.056 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.644 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 28.4 tp -63.76 -50.17 72.61 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-O 118.468 -0.777 . . . . 0.0 112.454 -175.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.8 Cg_exo -59.23 -26.49 81.98 Favored 'Trans proline' 0 C--N 1.356 0.964 0 CA-C-N 121.096 1.427 . . . . 0.0 110.827 169.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.589 HG12 ' O ' ' A' 1042 ' ' ALA . 38.7 t -75.09 -16.71 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.726 174.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.782 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 0.3 OUTLIER -64.57 -54.85 33.78 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.81 176.231 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.548 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 29.2 Cg_exo -62.2 -25.61 77.09 Favored 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 120.962 1.379 . . . . 0.0 110.406 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -68.11 -61.6 1.78 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.656 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.841 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 9.6 m -163.45 -50.22 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -172.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.661 HG22 ' HG ' ' A' ' 972' ' ' SER . 4.9 t -53.28 -15.99 1.15 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -172.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.782 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 8.9 p-80 -47.94 -20.78 0.35 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.425 ' HA ' ' HD2' ' A' ' 982' ' ' ARG . 9.1 tpt180 -76.86 -52.24 9.83 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.465 -0.894 . . . . 0.0 110.488 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.988 ' HB3' HG11 ' A' 1038 ' ' VAL . 0.0 OUTLIER -76.61 -39.07 53.61 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.757 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.578 HG21 ' HA ' ' A' ' 981' ' ' HIS . 10.6 tt -63.06 -25.35 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.891 -176.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -73.5 -40.85 63.75 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.303 171.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.635 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 15.7 ptp -70.9 -51.2 27.63 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.842 -0.743 . . . . 0.0 112.052 -173.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.564 ' CB ' HG22 ' A' 1038 ' ' VAL . . . -78.76 -40.12 34.22 Favored 'General case' 0 C--O 1.217 -0.625 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 1.057 ' HA ' HD13 ' A' ' 991' ' ' LEU . 6.6 tt0 -61.56 -44.75 96.46 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.208 -177.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.43 -26.18 64.48 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.572 0.701 . . . . 0.0 109.136 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 8.6 tp -72.25 -37.35 69.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.823 178.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.057 HD13 ' HA ' ' A' ' 988' ' ' GLN . 8.4 mt -61.58 -53.42 56.5 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.982 176.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -57.03 -37.49 71.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.494 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 4.5 p -71.65 -38.03 70.75 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -176.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.609 ' HA ' ' HB3' ' A' ' 997' ' ' GLU . 4.3 m-20 -106.77 -31.13 8.54 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 119.529 -0.868 . . . . 0.0 112.825 -172.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.799 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.7 OUTLIER -59.79 -45.46 92.22 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.24 91.16 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.848 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' A' 1001 ' ' LYS . 7.7 tp10 -53.03 -41.07 64.36 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.056 174.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.611 HD23 HD11 ' A' 1028 ' ' LEU . 40.9 tp -68.31 -38.99 82.14 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.243 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.78 ' HA ' HG11 ' A' ' 955' ' ' VAL . 77.7 mt -57.57 -51.21 72.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.298 0.57 . . . . 0.0 110.64 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.631 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -78.47 -11.72 59.97 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.531 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.726 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 0.8 OUTLIER -84.42 -32.95 23.83 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.311 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.912 ' HE2' ' HE3' ' A' ' 954' ' ' MET . 43.7 mmm -78.71 -39.49 36.33 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.738 ' O ' ' HB2' ' A' 1007 ' ' GLN . 84.1 tttt -55.79 -51.01 68.91 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.536 -1.211 . . . . 0.0 108.488 169.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.7 tp -57.28 -46.2 83.33 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.48 96.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.385 0.612 . . . . 0.0 110.35 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.0 pp0? -76.68 -10.66 59.54 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.446 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.738 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.6 tp-100 -87.95 -16.71 33.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.408 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 60.9 t80 -128.6 11.14 6.21 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.951 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.644 HG21 ' HG3' ' A' ' 948' ' ' PRO . 3.7 p -51.51 110.02 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.689 0.757 . . . . 0.0 111.699 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.511 ' HG3' ' HB2' ' A' 1013 ' ' LEU . 24.7 ptm -149.48 169.75 20.17 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.576 178.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.8 m -59.13 114.46 2.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.217 -175.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.55 ' O ' ' HG2' ' A' 1015 ' ' GLN . 19.4 m 74.46 -34.06 0.26 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.801 0.84 . . . . 0.0 112.932 172.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.511 ' HB2' ' HG3' ' A' 1010 ' ' MET . 4.3 mm? -82.06 -7.84 59.63 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.206 -0.309 . . . . 0.0 111.557 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.554 ' HG3' HG23 ' A' 1009 ' ' VAL . 1.0 OUTLIER -64.87 -36.81 85.56 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.676 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 19.7 pt20 -61.69 -32.28 72.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.453 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -50.44 -42.87 54.75 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 111.602 0.223 . . . . 0.0 111.602 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.608 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 4.5 m-30 -84.6 -19.62 32.74 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.225 0.536 . . . . 0.0 110.219 178.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.676 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.7 tttm -75.37 -32.11 60.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.49 177.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -76.44 -41.2 48.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -48.46 -40.14 25.3 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.554 166.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.619 ' HB3' ' O ' ' A' 1018 ' ' LYS . 1.3 tmt? -57.22 -46.71 82.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.252 173.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.57 -38.4 89.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.36 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.1 m -68.51 -37.08 79.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.894 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.91 -41.57 36.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.643 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.557 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -63.05 -31.79 73.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.258 0.552 . . . . 0.0 110.497 178.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.462 ' O ' HG23 ' A' 1030 ' ' VAL . 6.0 t60 -71.64 -44.13 64.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.775 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.86 94.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.698 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.799 HD13 ' HA ' ' A' ' 995' ' ' LEU . 5.5 tt -55.63 -53.53 55.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.178 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.77 -31.09 64.27 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.573 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.752 ' HA ' ' HG2' ' A' 1033 ' ' LYS . 80.6 t -66.06 -43.51 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.867 174.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.476 ' CB ' HD21 ' A' ' 991' ' ' LEU . 8.4 m-20 -51.35 -46.4 62.68 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.05 0.452 . . . . 0.0 109.838 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.605 ' HB1' HD22 ' A' ' 932' ' ' LEU . . . -60.9 -53.25 59.54 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.117 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.752 ' HG2' ' HA ' ' A' 1030 ' ' VAL . 15.0 ptmm? -65.75 -32.14 73.52 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -174.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.667 ' O ' HG21 ' A' 1038 ' ' VAL . 4.8 t30 -73.43 -36.85 66.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.511 -0.475 . . . . 0.0 109.998 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.914 HD22 HD12 ' A' ' 991' ' ' LEU . 9.9 tp -79.81 -26.96 40.34 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.713 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.839 ' HA ' HG12 ' A' ' 929' ' ' VAL . 3.9 pp -64.79 -27.11 68.67 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.563 ' O ' ' HG2' ' A' 1041 ' ' GLN . 31.4 t70 -75.31 -45.91 36.7 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.219 -1.355 . . . . 0.0 108.921 170.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.988 HG11 ' HB3' ' A' ' 983' ' ' GLU . 55.7 t -53.31 -61.27 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.758 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.107 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.937 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.8 pt -81.33 -32.7 12.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -172.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.61 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 8.6 t0 -54.6 -44.53 73.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.201 166.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.65 ' O ' ' HG2' ' A' 1045 ' ' LYS . 27.3 pt20 -78.47 -22.61 47.27 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.852 177.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.614 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.58 -55.35 30.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 118.478 0.581 . . . . 0.0 110.064 169.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.789 ' HB2' HG22 ' A' ' 925' ' ' VAL . 7.0 tpt180 -55.56 -33.86 64.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.131 175.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.508 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 66.1 tp -76.56 -26.3 54.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.439 175.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.841 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 69.0 mmtt -64.24 -34.63 78.55 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.0 ttp -71.41 -40.87 70.22 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.804 -1.543 . . . . 0.0 109.203 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.476 ' HB ' HD12 ' A' 1044 ' ' LEU . 48.6 mm -62.32 -35.02 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.809 172.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 31.2 t -60.7 -40.19 91.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.316 -175.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -88.2 -17.14 31.49 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.561 -0.455 . . . . 0.0 111.621 -177.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 58.0 m -72.32 -33.63 67.49 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 171.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 54.32 82.3 0.25 Allowed Pre-proline 0 N--CA 1.461 0.1 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.509 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.77 12.16 2.46 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.222 2.614 . . . . 0.0 113.024 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 52.9 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.996 -178.092 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.819 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 6.7 tpt180 . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -75.73 39.88 0.18 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.757 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.776 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.1 OUTLIER 43.32 69.93 0.35 Allowed 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 124.229 1.011 . . . . 0.0 111.801 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 925' ' ' VAL . 2.1 t70 -47.02 -173.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 O-C-N 126.042 2.089 . . . . 0.0 113.058 -171.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 0.6 OUTLIER -46.54 -12.11 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.605 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.734 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -65.4 -54.65 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.751 171.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.45 ' CD1' ' HB2' ' A' 1040 ' ' ASP . 52.2 t80 -78.88 -29.13 44.21 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 122.144 0.973 . . . . 0.0 108.64 -176.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.508 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 38.5 mt-10 -65.41 -62.47 1.51 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.075 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.457 HD22 HG21 ' A' ' 964' ' ' THR . 57.3 t30 -71.56 -32.52 68.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.985 -170.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.863 HG23 HD12 ' A' ' 965' ' ' LEU . 14.4 p -60.6 -38.02 77.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.44 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 55.6 m -65.49 -32.85 74.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 172.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.82 -33.2 67.44 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.866 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.493 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 21.0 tp -62.7 -43.0 99.93 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 117.383 0.591 . . . . 0.0 109.43 174.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.513 ' O ' HG12 ' A' ' 937' ' ' ILE . 27.4 t -63.53 -42.08 94.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.689 176.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.569 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.9 mmpt? -65.27 -31.01 71.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.644 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.02 -25.14 43.27 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.479 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' A' ' 933' ' ' VAL . 14.7 p -81.99 -11.32 12.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 C-N-CA 119.728 -0.789 . . . . 0.0 109.228 171.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 46.5 mm -72.34 -36.19 54.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 165.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.6 mm-40 -53.15 -38.05 62.39 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.372 170.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.493 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 57.5 ttp -58.16 -45.45 87.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.793 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.599 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 48.3 m -65.46 -33.07 75.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.666 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.753 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.2 m -77.46 -37.03 52.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.986 0.898 . . . . 0.0 108.943 -177.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.2 mmtp -70.01 -29.7 66.82 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.901 -1.499 . . . . 0.0 111.671 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 1.049 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 15.4 tt -79.49 -23.29 12.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.318 0.58 . . . . 0.0 110.462 178.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 940' ' ' SER . 84.2 mm-40 -55.27 -56.02 33.2 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.753 ' HD3' ' O ' ' A' ' 941' ' ' SER . 13.4 Cg_endo -91.31 -4.08 4.35 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.766 1.644 . . . . 0.0 115.421 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.724 ' HB2' ' HB3' ' A' ' 950' ' ' GLU . . . -129.86 162.0 56.15 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.538 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 3.2 Cg_exo -80.61 -178.83 4.7 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 124.283 3.322 . . . . 0.0 110.908 168.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.936 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 5.9 Cg_endo -47.59 -18.37 0.9 Allowed 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 124.712 3.608 . . . . 0.0 115.689 -168.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.38 -4.18 1.73 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 170.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 1.049 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.1 OUTLIER -96.03 -27.87 14.9 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 173.155 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 1.063 ' HA ' ' HE3' ' A' ' 954' ' ' MET . 11.1 m-85 -43.53 -47.36 7.28 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.983 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -69.75 -59.58 4.48 Favored Pre-proline 0 CA--C 1.555 1.152 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.814 177.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.983 ' HD3' HG12 ' A' ' 952' ' ' VAL . 51.2 Cg_exo -59.33 -35.92 95.66 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.338 2.026 . . . . 0.0 114.873 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 1.063 ' HE3' ' HA ' ' A' ' 951' ' ' TYR . 24.0 ptt? -64.01 -47.61 79.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -177.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.658 ' HB ' ' HB3' ' A' 1002 ' ' MET . 72.0 t -66.32 -27.0 39.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.55 174.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 88.2 tttt -62.71 -38.34 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.5 mm-40 -54.04 -45.37 71.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.883 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.637 ' HB ' HD23 ' A' ' 998' ' ' LEU . 1.9 t -71.71 -22.61 21.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.022 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.587 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -72.62 -45.79 34.37 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.109 -178.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.03 -21.61 66.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.826 0.346 . . . . 0.0 110.483 171.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 958' ' ' VAL . . . -62.34 -56.91 13.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.995 178.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.873 HD11 ' HB3' ' A' ' 991' ' ' LEU . 8.3 tt -70.66 -27.26 63.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.195 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -54.51 45.12 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.022 170.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.457 HG21 HD22 ' A' ' 928' ' ' ASN . 24.8 m -53.89 -38.55 64.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.599 174.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.863 HD12 HG23 ' A' ' 929' ' ' VAL . 0.4 OUTLIER -64.33 -29.6 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.418 178.695 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.415 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 34.5 tp -63.97 -31.95 73.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.507 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.49 91.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.558 0.694 . . . . 0.0 110.045 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.734 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.9 m -62.99 -39.0 93.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.423 173.238 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.771 HG13 HD12 ' A' ' 984' ' ' ILE . 87.0 t -54.88 -31.73 25.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.286 174.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.501 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 0.9 OUTLIER -73.95 -23.19 59.46 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 176.62 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.629 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.4 mm-40 -67.62 -52.92 32.54 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 122.71 1.243 . . . . 0.0 109.001 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.405 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 9.6 p -66.8 -23.08 66.02 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.233 -1.348 . . . . 0.0 111.206 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.677 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 37.8 tp -55.76 -53.76 59.22 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-O 118.921 -0.561 . . . . 0.0 112.077 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 37.5 Cg_exo -61.09 -24.64 79.76 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.336 1.357 . . . . 0.0 111.246 170.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.646 HG12 ' HB ' ' A' ' 980' ' ' THR . 38.3 t -74.49 -13.94 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.334 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.974 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.3 tt -70.34 -53.16 10.72 Favored Pre-proline 0 C--O 1.234 0.27 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.407 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.494 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 33.9 Cg_exo -61.24 -25.5 80.71 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.178 1.252 . . . . 0.0 110.96 173.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.08 -64.97 0.77 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.22 174.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.799 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.4 m -163.46 -35.28 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -173.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.699 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 1.0 OUTLIER -61.47 -14.11 26.21 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -171.574 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.974 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 9.7 p-80 -50.15 -19.16 0.7 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -172.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.479 ' HE ' ' HA ' ' A' ' 982' ' ' ARG . 2.6 tpm_? -73.8 -52.72 12.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.58 176.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.902 ' HB3' HG12 ' A' 1038 ' ' VAL . 3.1 mp0 -77.05 -43.95 32.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.771 HD12 HG13 ' A' ' 969' ' ' VAL . 9.8 tp -56.97 -30.13 33.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.65 -174.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.71 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 10.5 mm-40 -73.02 -45.13 59.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.38 172.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.741 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 14.3 ptp -62.72 -54.41 39.61 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.648 -170.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.759 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -74.88 -35.55 62.3 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.14 -176.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.881 ' HA ' HD11 ' A' ' 991' ' ' LEU . 6.4 tp-100 -59.59 -40.27 86.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.716 -176.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 69.1 mmtt -61.24 -42.35 98.46 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.653 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -65.75 -38.3 88.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.292 179.129 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.881 HD11 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -61.8 -47.03 86.97 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.428 0.632 . . . . 0.0 109.888 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -57.81 -46.18 85.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.54 -177.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.7 p -70.81 -38.2 73.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.842 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.416 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 1.2 m-20 -91.42 -42.14 10.48 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -168.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.773 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.6 tm? -59.92 -40.45 88.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 171.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.48 69.63 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.97 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.416 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 9.8 pt-20 -68.71 -28.86 67.21 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.663 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.816 HD21 HD13 ' A' 1028 ' ' LEU . 1.1 tp -56.97 -49.56 75.32 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.523 175.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.635 ' O ' ' HG3' ' A' 1002 ' ' MET . 29.7 pt -73.55 -24.71 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 120.849 0.356 . . . . 0.0 111.471 -179.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.679 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.4 m-80 -87.12 -1.11 57.65 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 121.96 -0.463 . . . . 0.0 109.869 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.991 ' HD2' ' HA ' ' A' 1021 ' ' MET . 5.5 ttpm? -82.99 -37.42 24.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.957 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -73.57 -37.64 65.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 173.151 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.851 ' O ' ' HB2' ' A' 1007 ' ' GLN . 53.8 tptt -56.63 -57.84 10.64 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.37 171.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.776 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 10.7 tp -55.29 -55.26 33.49 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.4 81.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 110.723 -177.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.7 -13.26 60.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.526 0.679 . . . . 0.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.851 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.7 tp-100 -79.79 -31.6 40.81 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.107 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.557 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 67.0 t80 -118.1 17.49 14.03 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.12 -176.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.505 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 7.3 p -57.7 94.9 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 122.224 1.011 . . . . 0.0 111.322 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.575 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 50.3 ttm -118.25 47.79 1.53 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.063 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 15.7 m 58.76 -92.02 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.021 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 49.5 m -86.04 -30.87 22.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.661 0.267 . . . . 0.0 111.282 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.575 ' HB2' ' HB3' ' A' 1010 ' ' MET . 3.2 mm? -77.31 -9.0 58.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.223 0.535 . . . . 0.0 110.425 -178.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.505 ' HG3' ' HA ' ' A' 1009 ' ' VAL . 1.1 tm0? -68.52 -21.53 64.57 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.369 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.771 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 26.2 tt0 -60.55 -32.42 71.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.107 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.29 -43.77 22.68 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.262 169.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.776 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 7.2 m-30 -87.07 -7.36 58.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.083 0.468 . . . . 0.0 110.495 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.771 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 30.3 tptt -75.64 -26.41 57.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.654 169.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 67.7 mttm -72.35 -57.24 4.36 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -47.97 -35.56 11.02 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.471 169.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.991 ' HA ' ' HD2' ' A' 1001 ' ' LYS . 7.9 tpt -51.68 -48.69 63.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.263 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.54 -53.4 23.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.647 0.26 . . . . 0.0 110.851 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 15.2 m -59.95 -46.22 90.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.124 -174.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.859 ' HB3' ' HD3' ' A' 1001 ' ' LYS . . . -74.59 -31.97 62.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.689 0.28 . . . . 0.0 111.681 -173.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.648 ' HB1' ' HE3' ' A' 1001 ' ' LYS . . . -75.47 -37.54 60.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.956 0.408 . . . . 0.0 110.451 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 26.5 t60 -70.38 -30.3 67.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.278 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.42 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -68.95 -34.76 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.376 176.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.816 HD13 HD21 ' A' ' 998' ' ' LEU . 0.6 OUTLIER -63.95 -42.47 97.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 122.145 0.974 . . . . 0.0 109.715 173.118 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.9 -33.56 64.75 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.349 176.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.42 ' HB ' ' O ' ' A' 1027 ' ' ALA . 82.6 t -66.63 -33.77 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 172.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.737 ' HB2' HD22 ' A' ' 991' ' ' LEU . 1.9 p30 -72.36 -38.78 68.45 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.477 ' HB2' HD21 ' A' ' 932' ' ' LEU . . . -61.15 -44.72 96.87 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.692 171.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.654 ' O ' ' HG ' ' A' 1036 ' ' LEU . 60.0 tttm -63.76 -42.13 97.88 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.792 -176.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.586 ' O ' HG22 ' A' 1038 ' ' VAL . 66.1 t30 -73.2 -40.01 65.09 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.375 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.772 ' O ' HG12 ' A' 1039 ' ' ILE . 18.1 tp -73.76 -31.65 63.43 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.597 -177.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.781 ' HA ' HG12 ' A' ' 929' ' ' VAL . 4.3 pp -62.29 -37.02 83.92 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.464 ' N ' HD13 ' A' 1036 ' ' LEU . 29.2 t70 -75.67 -37.92 59.18 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.386 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.902 HG12 ' HB3' ' A' ' 983' ' ' GLU . 4.8 t -53.59 -59.07 2.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.98 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.772 HD13 ' HB ' ' A' ' 929' ' ' VAL . 3.5 pt -85.83 -24.73 6.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.153 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.45 ' HB2' ' CD1' ' A' ' 926' ' ' TYR . 19.7 t70 -61.08 -39.27 89.3 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.475 162.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.714 ' O ' ' HG2' ' A' 1045 ' ' LYS . 35.7 mt-30 -68.21 -35.08 77.42 Favored 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.393 171.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.62 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.98 -49.49 71.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.122 0.487 . . . . 0.0 110.717 174.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.819 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -47.4 -41.46 20.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.624 172.216 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.532 ' N ' ' HD3' ' A' 1043 ' ' ARG . 26.3 tp -79.97 -32.44 39.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.278 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.799 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 31.6 mmtp -63.13 -42.18 99.46 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.325 0.583 . . . . 0.0 109.973 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 25.6 ttt -69.12 -33.65 73.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.81 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.573 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 31.6 mm -69.53 -41.86 80.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.934 173.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 70.5 m -54.38 -28.03 40.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.615 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.49 -45.96 9.04 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 18.9 m -61.16 -37.97 84.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.091 0.472 . . . . 0.0 110.633 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.461 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 4.9 mtp180 -80.41 122.05 82.18 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 173.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 11.3 Cg_exo -72.51 44.07 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.317 2.678 . . . . 0.0 113.075 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 38.5 m-70 . . . . . 0 C--O 1.245 0.864 0 CA-C-O 118.694 -0.669 . . . . 0.0 110.439 -179.894 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.92 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 2.2 tpm_? . . . . . 0 N--CA 1.449 -0.495 0 CA-C-O 120.742 0.306 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.412 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 38.3 m -123.59 46.14 2.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.684 -174.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 44.9 55.95 5.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.881 0.872 . . . . 0.0 112.934 173.491 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.592 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 23.8 t0 -47.8 -175.05 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.717 0 O-C-N 125.399 1.687 . . . . 0.0 111.845 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.524 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.2 tmtm? -37.0 -21.02 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.12 0.968 . . . . 0.0 112.874 -179.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.843 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 6.9 m -59.69 -51.44 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 O-C-N 122.144 -0.348 . . . . 0.0 111.299 173.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.426 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 27.4 t80 -75.63 -31.89 60.03 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -173.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.76 -58.07 7.23 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.874 -1.512 . . . . 0.0 111.651 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -70.6 -30.43 67.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.123 -173.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.633 HG22 HD12 ' A' ' 965' ' ' LEU . 61.2 t -66.19 -41.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.973 -0.691 . . . . 0.0 109.884 175.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.68 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 67.3 m -60.19 -35.86 76.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 169.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -59.52 -33.96 79.1 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.519 174.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.694 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 5.3 tt -63.7 -45.9 87.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.659 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.8 t -57.09 -42.54 79.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.915 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.68 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -63.71 -40.85 97.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.418 178.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 961' ' ' ALA . . . -79.16 -26.55 42.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.959 -177.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.596 ' O ' ' HB3' ' A' ' 939' ' ' MET . 15.0 p -79.01 -14.53 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.697 0.761 . . . . 0.0 109.128 172.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 933' ' ' VAL . 24.4 mm -69.83 -31.43 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 167.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.551 ' HG3' ' HA ' ' A' ' 935' ' ' ALA . 36.2 mt-10 -61.27 -39.05 88.97 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.939 174.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.727 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 43.6 ttp -51.37 -47.06 62.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.334 172.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.6 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.9 t -71.9 -39.18 69.74 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.048 178.17 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.419 ' HA ' HE21 ' A' ' 944' ' ' GLN . 46.7 m -71.71 -50.88 26.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.159 0.504 . . . . 0.0 110.564 -169.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.616 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -82.98 -11.48 58.1 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.566 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.912 HG13 ' HE1' ' A' ' 954' ' ' MET . 0.0 OUTLIER -77.17 -45.79 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.212 0.46 . . . . 0.0 111.378 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.6 ' HG2' ' O ' ' A' ' 940' ' ' SER . 0.1 OUTLIER -59.05 -46.81 99.42 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -173.349 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.584 ' HD3' ' HG3' ' A' ' 944' ' ' GLN . 79.2 Cg_endo -87.96 16.08 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.438 1.425 . . . . 0.0 113.545 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.659 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -125.72 154.26 73.15 Favored Pre-proline 0 C--N 1.328 -0.364 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.39 175.27 10.91 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 123.157 2.571 . . . . 0.0 111.821 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.911 ' HB3' HE21 ' A' 1006 ' ' GLN . 88.7 Cg_exo -50.24 -35.39 43.22 Favored 'Trans proline' 0 C--O 1.248 0.998 0 C-N-CA 123.118 2.545 . . . . 0.0 113.121 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -55.18 -25.27 31.45 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.857 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.659 ' HB2' ' HB2' ' A' ' 946' ' ' ALA . 53.3 mm-40 -106.94 -3.16 20.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.729 ' O ' ' HG3' ' A' ' 954' ' ' MET . 9.7 m-30 -61.31 -47.31 86.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 173.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.926 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.58 -44.01 12.2 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.876 177.019 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.926 ' HD3' HG12 ' A' ' 952' ' ' VAL . 88.5 Cg_exo -55.02 -29.72 66.34 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.805 1.67 . . . . 0.0 115.239 171.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.912 ' HE1' HG13 ' A' ' 943' ' ' ILE . 0.0 OUTLIER -72.95 -30.69 64.05 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.968 0.889 . . . . 0.0 109.644 178.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.798 HG13 ' HA ' ' A' ' 999' ' ' ILE . 0.6 OUTLIER -71.37 -26.2 26.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.003 174.455 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 953' ' ' PRO . 8.6 mtmp? -58.15 -38.53 76.76 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.438 175.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.59 -45.98 77.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.711 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.481 ' CG2' ' HB2' ' A' ' 939' ' ' MET . 2.2 t -65.42 -32.77 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.002 0.43 . . . . 0.0 110.788 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.79 -41.67 97.46 Favored Glycine 0 C--O 1.228 -0.232 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.775 177.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 62.6 tp -68.91 -33.47 73.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.242 0.544 . . . . 0.0 109.653 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.715 ' HB3' ' HB3' ' A' ' 935' ' ' ALA . . . -53.64 -57.07 12.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.766 177.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.939 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -74.68 -21.13 59.57 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.578 -179.497 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -53.84 13.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.831 0.348 . . . . 0.0 110.322 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 7.0 m -58.22 -27.81 64.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.907 0.861 . . . . 0.0 109.488 173.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.675 HD21 HD22 ' A' 1035 ' ' LEU . 17.4 tp -70.76 -37.27 73.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.889 178.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -51.01 -33.39 24.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.882 172.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.84 77.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.798 0.332 . . . . 0.0 110.413 173.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.757 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.6 m -58.35 -46.1 86.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.306 173.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.781 HG13 HD13 ' A' ' 984' ' ' ILE . 96.6 t -52.43 -30.25 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.968 175.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.4 t70 -70.98 -29.06 64.94 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.289 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.629 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.5 mm-40 -65.57 -57.04 9.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.53 1.157 . . . . 0.0 109.036 172.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.483 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 53.0 p -58.5 -22.98 56.86 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.0 -1.0 . . . . 0.0 113.065 174.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.652 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 43.0 tp -56.83 -54.24 56.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.556 -179.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.652 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 52.3 Cg_exo -57.91 -23.71 60.95 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 121.6 1.533 . . . . 0.0 111.648 168.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.54 HG12 ' HB ' ' A' ' 980' ' ' THR . 44.0 t -74.89 -16.22 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.815 175.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.543 ' HB2' HG22 ' A' ' 984' ' ' ILE . 1.0 OUTLIER -69.01 -48.08 28.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 118.973 -0.537 . . . . 0.0 111.641 176.688 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.531 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 39.9 Cg_exo -60.5 -26.51 82.96 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 121.156 1.237 . . . . 0.0 111.103 170.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.629 ' HA ' ' OE1' ' A' 1049 ' ' GLN . . . -70.42 -66.6 0.58 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.803 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.793 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.0 m -165.46 -27.27 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -174.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.614 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 2.8 t -65.13 -12.81 54.97 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -172.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.542 ' CD2' ' HG3' ' A' ' 985' ' ' GLU . 3.7 t60 -45.8 -44.5 14.11 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 122.761 0.424 . . . . 0.0 111.621 -169.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -55.18 -53.53 54.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 1.08 ' HB3' HG12 ' A' 1038 ' ' VAL . 1.0 OUTLIER -75.2 -43.45 51.88 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.781 HD13 HG13 ' A' ' 969' ' ' VAL . 11.3 tp -62.64 -26.62 41.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.297 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.542 ' HG3' ' CD2' ' A' ' 981' ' ' HIS . 1.3 mm-40 -74.08 -38.32 63.93 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.366 171.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.734 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 12.1 ptp -66.19 -62.44 1.48 Allowed 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.175 -174.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.699 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.23 -36.61 39.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -173.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.656 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.5 OUTLIER -69.47 -43.14 73.81 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.56 -175.064 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -66.36 -27.66 68.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.511 0.672 . . . . 0.0 109.244 173.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.511 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.8 tp -72.01 -39.92 68.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.494 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.824 HD13 HD21 ' A' 1035 ' ' LEU . 29.1 mt -59.76 -61.14 2.84 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.588 178.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -47.17 -37.8 10.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.113 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 71.0 m -67.43 -57.57 6.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.661 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.58 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 3.7 m-20 -93.66 -15.99 24.75 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.939 ' HG ' HD23 ' A' ' 962' ' ' LEU . 2.5 tm? -61.22 -50.6 72.41 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.626 1.103 . . . . 0.0 108.338 163.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.762 ' O ' ' HB3' ' A' 1000 ' ' ASN . . . -52.9 -30.73 35.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.544 172.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.691 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.8 tp10 -64.32 -45.24 88.75 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.676 HD12 ' HE1' ' A' 1021 ' ' MET . 4.1 mm? -77.54 -50.39 12.69 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.51 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.798 ' HA ' HG13 ' A' ' 955' ' ' VAL . 15.6 tt -57.0 -21.03 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 121.696 0.76 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.762 ' HB3' ' O ' ' A' ' 996' ' ' ALA . 0.6 OUTLIER -109.44 -22.19 12.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.578 -173.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.691 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 9.0 tptm -84.48 -36.45 22.26 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 123.126 0.266 . . . . 0.0 111.029 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.728 ' HA ' ' HE3' ' A' 1002 ' ' MET . 0.3 OUTLIER -78.69 -36.07 44.13 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.854 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.2 ttpt -58.73 -37.59 76.5 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 167.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' 1000 ' ' ASN . 8.4 tt -68.85 -50.13 52.49 Favored 'General case' 0 C--O 1.214 -0.776 0 O-C-N 123.774 0.671 . . . . 0.0 110.295 -176.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.592 ' HA ' ' HB2' ' A' 1017 ' ' TYR . . . -55.55 -46.39 77.13 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.804 0.811 . . . . 0.0 109.959 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.911 HE21 ' HB3' ' A' ' 948' ' ' PRO . 0.9 OUTLIER -76.19 -13.54 60.18 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.777 -178.707 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.854 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -95.96 -40.42 9.29 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.412 0.625 . . . . 0.0 111.593 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 51.3 t80 -89.51 1.98 55.18 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.803 -176.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.655 HG23 ' HG3' ' A' 1014 ' ' GLN . 5.9 p -30.4 125.08 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 113.73 -1.577 . . . . 0.0 114.313 -179.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.456 ' SD ' HD22 ' A' 1013 ' ' LEU . 41.5 ttm -133.22 148.2 52.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.669 171.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 8.0 m -51.0 112.25 0.69 Allowed 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.391 0.432 . . . . 0.0 111.345 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 t 75.24 -41.52 0.46 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.877 0.871 . . . . 0.0 112.238 176.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.456 HD22 ' SD ' ' A' 1010 ' ' MET . 8.8 mp -72.38 -8.44 54.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.655 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -54.58 -41.05 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.521 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -59.17 -25.79 64.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.004 -172.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -54.52 -58.5 7.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.35 0.595 . . . . 0.0 109.847 173.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.592 ' HB2' ' HA ' ' A' 1005 ' ' ALA . 0.1 OUTLIER -55.0 -33.14 62.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.539 177.759 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 58.2 tttm -71.38 -45.47 62.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.904 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.62 -27.97 64.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.857 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.91 -44.08 94.49 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 170.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.676 ' HE1' HD12 ' A' ' 998' ' ' LEU . 1.7 tmt? -61.82 -42.08 98.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.581 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.91 -39.04 76.97 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.162 0.506 . . . . 0.0 110.784 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 31.4 m -69.57 -46.74 65.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.149 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.542 ' O ' HD23 ' A' ' 998' ' ' LEU . . . -60.67 -36.09 77.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.543 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.465 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -59.04 -35.8 73.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.086 0.47 . . . . 0.0 110.754 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG21 ' A' 1030 ' ' VAL . 16.2 t-160 -67.31 -31.7 72.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.78 177.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.49 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -72.35 -55.74 6.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.062 -178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.914 HD21 ' HA ' ' A' ' 995' ' ' LEU . 24.5 tp -58.74 -35.85 73.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.046 0.451 . . . . 0.0 111.531 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.41 -36.93 66.99 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.879 0.371 . . . . 0.0 111.548 170.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' 1026 ' ' HIS . 82.6 t -64.14 -36.18 76.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 175.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.58 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 11.0 m-20 -60.59 -44.56 96.11 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.982 0.42 . . . . 0.0 110.486 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.535 ' HB3' HD22 ' A' ' 932' ' ' LEU . . . -59.52 -54.0 51.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.514 174.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -53.37 -38.29 63.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.408 ' O ' HG22 ' A' 1038 ' ' VAL . 54.0 t30 -71.58 -54.02 11.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.186 -178.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.824 HD21 HD13 ' A' ' 991' ' ' LEU . 15.0 tp -57.52 -33.19 67.81 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.885 179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.569 ' N ' HG11 ' A' ' 929' ' ' VAL . 38.7 tp -52.62 -47.29 67.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.857 0.837 . . . . 0.0 109.842 176.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.3 t70 -68.51 -42.15 78.94 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.355 174.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 1.08 HG12 ' HB3' ' A' ' 983' ' ' GLU . 17.0 t -52.97 -61.91 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.459 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.781 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.864 HD13 ' H ' ' A' 1040 ' ' ASP . 1.4 pp -82.45 -30.2 9.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.864 ' H ' HD13 ' A' 1039 ' ' ILE . 44.1 t0 -56.88 -37.49 71.45 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 165.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.669 ' O ' ' HG2' ' A' 1045 ' ' LYS . 2.7 mp0 -73.15 -36.56 66.68 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 114.536 -1.211 . . . . 0.0 109.63 172.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.666 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.49 -52.44 59.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.24 0.543 . . . . 0.0 111.232 176.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.92 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 0.3 OUTLIER -58.83 -31.0 68.08 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.94 179.198 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 920' ' ' ARG . 11.1 mp -77.88 -31.85 51.59 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.943 -0.117 . . . . 0.0 111.22 171.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.793 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 32.9 mmtp -59.87 -36.93 77.94 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.812 0.815 . . . . 0.0 108.915 175.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.517 ' HE1' ' HG2' ' A' 1052 ' ' PRO . 42.2 ttp -69.22 -36.81 77.61 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.473 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.539 ' HA ' ' HA ' ' A' 1051 ' ' ARG . 48.6 mm -64.69 -42.45 95.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.539 172.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 37.3 m -55.98 -46.61 78.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.841 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.629 ' OE1' ' HA ' ' A' ' 978' ' ' ALA . 24.9 tt0 -59.46 -55.71 31.16 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.575 0.226 . . . . 0.0 111.581 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 33.8 t -159.46 -9.34 0.06 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.657 -0.417 . . . . 0.0 112.066 -175.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.539 ' HA ' ' HA ' ' A' 1047 ' ' ILE . 16.5 ttp180 59.8 99.14 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.793 -175.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.517 ' HG2' ' HE1' ' A' 1046 ' ' MET . 49.2 Cg_exo -56.8 125.96 20.71 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.014 2.476 . . . . 0.0 113.236 -176.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 16.3 p80 . . . . . 0 C--O 1.248 0.974 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.635 176.984 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.983 ' HG3' ' HB2' ' A' 1043 ' ' ARG . 3.4 mmp_? . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 32.4 t 63.19 16.52 9.46 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -166.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 923' ' ' ASP . 1.3 m120 55.65 72.33 0.49 Allowed 'General case' 0 CA--C 1.498 -1.047 0 CA-C-N 114.326 -1.307 . . . . 0.0 109.602 -174.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.549 ' C ' ' H ' ' A' ' 925' ' ' VAL . 4.8 t70 -46.63 -174.75 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.532 0 O-C-N 126.299 2.249 . . . . 0.0 113.074 -168.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.59 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 3.1 tmtm? -46.9 -8.05 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.731 0.812 . . . . 0.0 112.307 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.703 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 0.0 OUTLIER -72.26 -49.76 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 C-N-CA 122.704 0.402 . . . . 0.0 110.896 174.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 14.9 t80 -73.3 -25.81 60.81 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.111 0.958 . . . . 0.0 108.416 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.421 ' O ' ' HB ' ' A' ' 930' ' ' THR . 97.1 mt-10 -73.54 -57.4 4.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.333 -177.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -66.49 -32.79 74.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.491 -171.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.966 HG12 ' HA ' ' A' 1036 ' ' LEU . 12.2 p -67.38 -40.97 85.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.789 177.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 934' ' ' LYS . 59.6 m -53.8 -31.99 51.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.821 0.343 . . . . 0.0 110.694 166.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . 0.495 ' HA2' ' HB2' ' A' ' 934' ' ' LYS . . . -66.99 -31.97 79.52 Favored Glycine 0 C--O 1.227 -0.307 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 176.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 1.127 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 18.9 tp -61.57 -51.06 70.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 173.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.5 t -60.87 -31.37 49.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.275 0.56 . . . . 0.0 110.906 174.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.559 ' HD2' HG22 ' A' ' 930' ' ' THR . 0.0 OUTLIER -72.13 -43.53 64.55 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.008 -178.572 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 1.007 ' HB1' ' HB3' ' A' ' 961' ' ' ALA . . . -75.83 -25.26 56.11 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 122.201 -0.312 . . . . 0.0 111.349 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.562 ' HA ' HG11 ' A' ' 958' ' ' VAL . 7.5 p -75.87 -13.05 14.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 119.636 -0.825 . . . . 0.0 109.644 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.667 HG12 ' O ' ' A' ' 933' ' ' VAL . 37.4 mm -71.11 -31.04 43.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 168.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 12.2 mm-40 -57.88 -40.71 80.88 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 171.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.457 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 47.6 ttp -56.47 -45.22 81.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.572 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.477 ' O ' HG23 ' A' ' 943' ' ' ILE . 16.2 p -73.19 -31.54 64.27 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.593 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 8.0 p -78.5 -40.8 34.23 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -177.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 4.4 mmtp -52.37 -47.16 66.34 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.47 174.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.602 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 16.5 tt -70.67 -22.35 23.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.522 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.812 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 32.9 mm-40 -55.68 -61.98 5.33 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.579 178.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.812 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 12.2 Cg_endo -92.92 -31.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.833 1.689 . . . . 0.0 114.086 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.545 ' HB2' ' HG3' ' A' ' 950' ' ' GLU . . . -83.82 150.41 58.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.218 0.532 . . . . 0.0 112.371 -169.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.618 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 72.6 Cg_endo -83.87 -177.83 3.28 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.371 2.714 . . . . 0.0 113.156 -177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.618 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 4.8 Cg_endo -49.3 -36.57 38.14 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 124.245 3.297 . . . . 0.0 113.96 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -55.06 -20.17 8.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.664 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.642 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 61.4 mm-40 -107.71 -4.96 17.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.615 ' HA ' ' HE1' ' A' ' 954' ' ' MET . 14.9 m-30 -57.61 -42.19 82.75 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.003 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.49 -46.87 3.3 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 119.181 -1.007 . . . . 0.0 112.531 177.347 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.003 ' HD3' HG12 ' A' ' 952' ' ' VAL . 78.2 Cg_exo -57.49 -29.45 84.78 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.562 1.508 . . . . 0.0 114.676 171.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.615 ' HE1' ' HA ' ' A' ' 951' ' ' TYR . 19.6 ptp -73.81 -31.88 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.446 0.641 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.72 HG11 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -72.29 -25.6 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.325 174.111 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 17.9 tppt? -58.57 -41.68 86.22 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.443 ' H ' ' HG2' ' A' ' 957' ' ' GLU . 3.9 mm-40 -52.99 -45.82 68.01 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.884 175.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.667 HG21 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -66.69 -29.71 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.022 178.119 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.517 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -67.4 -41.69 90.57 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.91 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.72 -40.6 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 109.901 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 1.127 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -48.45 -57.48 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 173.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.733 ' HB2' HD11 ' A' ' 995' ' ' LEU . 5.2 tt -70.52 -28.9 65.3 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 119.162 -1.015 . . . . 0.0 111.651 177.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -56.8 -57.24 13.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.701 0.286 . . . . 0.0 110.746 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 1.7 p -58.57 -44.55 89.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.18 0.514 . . . . 0.0 110.365 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 57.1 tp -51.1 -41.58 60.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.133 175.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 73.8 mt -54.82 -36.52 65.07 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.93 93.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.972 0.415 . . . . 0.0 109.978 175.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.673 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -63.85 -38.94 92.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.016 173.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 82.0 t -54.79 -31.9 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 O-C-N 122.235 -0.291 . . . . 0.0 110.802 172.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 2.7 m-20 -73.03 -22.48 60.63 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.757 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.547 ' O ' HG22 ' A' ' 975' ' ' VAL . 19.5 mm-40 -74.23 -44.35 53.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.176 0.988 . . . . 0.0 108.638 171.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.488 ' OG ' HG21 ' A' ' 980' ' ' THR . 32.8 t -69.2 -24.13 63.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.892 177.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.711 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 55.7 tp -59.91 -50.68 85.33 Favored Pre-proline 0 C--O 1.218 -0.58 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.505 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.481 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 11.5 Cg_endo -61.12 -26.17 82.22 Favored 'Trans proline' 0 C--N 1.355 0.908 0 CA-C-N 121.424 1.544 . . . . 0.0 110.927 170.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.547 HG22 ' O ' ' A' ' 971' ' ' GLU . 2.9 t -77.15 -11.08 13.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.222 174.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.765 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 1.9 tt -69.16 -53.23 14.07 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.62 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.455 ' N ' HD22 ' A' ' 976' ' ' LEU . 45.0 Cg_endo -69.44 -19.46 37.61 Favored 'Trans proline' 0 C--N 1.358 1.048 0 CA-C-N 120.457 1.199 . . . . 0.0 110.933 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -67.97 -55.31 13.2 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.694 172.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.672 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 31.1 m -166.11 -35.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -175.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.807 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.4 m -64.17 -18.43 64.47 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -168.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.765 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 11.6 t-160 -48.81 -26.43 2.39 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -172.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -72.2 -56.1 6.12 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.383 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.763 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.11 -42.65 62.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.626 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.807 ' HB ' HG22 ' A' ' 980' ' ' THR . 12.0 tt -58.76 -30.94 43.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.195 -174.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -72.68 -37.73 67.8 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.285 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.602 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 13.6 ptp -67.23 -59.06 3.74 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.629 -176.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.867 ' HB1' HG21 ' A' 1038 ' ' VAL . . . -68.41 -45.57 72.28 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 1.136 ' HA ' HD11 ' A' ' 991' ' ' LEU . 6.1 tt0 -58.23 -44.32 88.19 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.616 -175.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -61.6 -33.88 74.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.424 0.63 . . . . 0.0 109.933 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.65 -42.55 61.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.469 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.136 HD11 ' HA ' ' A' ' 988' ' ' GLN . 14.5 mt -53.43 -58.13 8.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 174.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -45.65 -48.15 14.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.184 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.422 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 4.5 p -73.06 -47.62 43.07 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.011 -176.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.465 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.1 m-20 -82.09 -38.67 24.51 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -170.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.793 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.9 OUTLIER -56.26 -60.21 3.83 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.623 0.647 . . . . 0.0 109.798 170.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.45 -23.46 38.96 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.899 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 993' ' ' SER . 20.5 tt0 -70.56 -43.24 69.89 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.297 -0.961 . . . . 0.0 108.554 177.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.554 ' HA ' ' HB1' ' A' 1024 ' ' ALA . 0.3 OUTLIER -60.84 -47.54 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.624 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.7 mt -55.63 -68.55 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.381 -179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.818 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -54.05 -18.91 4.06 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 114.395 -1.275 . . . . 0.0 113.108 177.897 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.612 ' HG3' ' HB2' ' A' 1024 ' ' ALA . 24.6 mmtp -85.26 -37.69 19.74 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.873 0.761 . . . . 0.0 111.395 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.483 ' HE3' ' SD ' ' A' ' 954' ' ' MET . 57.2 mtp -79.18 -34.78 42.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.651 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.9 tttm -63.54 -40.94 98.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 113.568 -1.651 . . . . 0.0 108.699 170.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.818 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.3 tp -60.77 -46.82 88.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.041 173.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.454 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -58.97 -45.18 91.18 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.6 0.714 . . . . 0.0 109.989 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -77.12 -6.58 53.42 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.261 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.651 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp-100 -91.09 -22.46 20.71 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.319 175.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 64.6 t80 -121.45 20.08 11.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.48 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.541 HG21 ' HG3' ' A' 1014 ' ' GLN . 5.6 p -61.18 88.7 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 122.196 0.998 . . . . 0.0 110.706 176.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.644 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 11.0 tpt -121.2 67.79 0.88 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.819 -177.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 9.7 m 61.36 -89.44 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.001 177.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.3 t -105.53 -8.6 17.93 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 -177.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.644 ' HB2' ' HB3' ' A' 1010 ' ' MET . 87.5 mt -82.31 -9.08 59.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.287 0.565 . . . . 0.0 110.174 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.818 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.0 OUTLIER -67.06 -45.9 75.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.698 -175.556 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.501 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 9.5 tt0 -53.59 -36.08 61.56 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.37 -59.3 4.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.116 0.484 . . . . 0.0 111.44 175.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.676 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.1 m-30 -62.27 -35.74 79.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.858 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.818 ' HB2' HE22 ' A' 1014 ' ' GLN . 86.2 tttt -55.63 -39.35 70.7 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.575 172.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 26.5 tptp -68.29 -44.19 76.01 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -57.73 -33.08 68.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.96 174.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.732 ' HG2' ' O ' ' A' 1018 ' ' LYS . 9.0 ptt? -75.34 -25.66 57.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' 1018 ' ' LYS . 94.1 mt -71.15 -38.07 72.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.009 0.433 . . . . 0.0 109.857 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 98.9 m -59.76 -41.39 90.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.994 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.612 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -64.79 -38.39 90.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.159 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -62.6 -38.62 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.457 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.53 ' O ' HG23 ' A' 1030 ' ' VAL . 4.6 t-160 -68.78 -39.38 80.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.47 174.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.465 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -63.77 -51.64 63.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.782 -177.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.793 HD11 ' HA ' ' A' ' 995' ' ' LEU . 0.2 OUTLIER -60.79 -43.87 97.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.868 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.535 ' N ' HD21 ' A' 1028 ' ' LEU . . . -53.6 -28.3 31.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.819 173.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' 1026 ' ' HIS . 88.5 t -72.4 -45.71 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 121.221 -0.192 . . . . 0.0 110.736 174.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.752 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.3 p30 -64.49 -47.27 79.58 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.632 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' 1036 ' ' LEU . . . -52.96 -29.08 26.82 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.457 ' O ' HD12 ' A' 1036 ' ' LEU . 35.7 ttpt -83.49 -48.77 9.94 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.451 0.644 . . . . 0.0 109.308 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.534 ' O ' HG23 ' A' 1038 ' ' VAL . 2.2 t30 -61.54 -47.97 83.13 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.349 -176.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.869 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 12.6 tp -67.75 -33.22 74.42 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.798 -177.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.966 ' HA ' HG12 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -58.28 -27.43 64.03 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.543 0.687 . . . . 0.0 109.66 177.535 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.596 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.0 t0 -92.09 -34.49 14.35 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.636 -1.165 . . . . 0.0 108.694 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.869 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 21.7 t -63.62 -53.32 46.42 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 CA-C-N 115.423 -0.808 . . . . 0.0 113.108 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.777 HD12 ' HB ' ' A' ' 929' ' ' VAL . 4.1 pt -82.01 -30.49 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 122.432 -0.168 . . . . 0.0 111.228 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.895 ' O ' ' HD3' ' A' 1043 ' ' ARG . 19.9 t0 -53.78 -29.78 41.75 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 118.532 -1.267 . . . . 0.0 110.662 157.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.596 ' HG3' ' O ' ' A' 1037 ' ' ASP . 58.9 mt-30 -81.46 -28.73 34.01 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 120.372 -1.455 . . . . 0.0 109.742 169.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.626 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -55.18 -52.94 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.823 0.344 . . . . 0.0 110.843 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.983 ' HB2' ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -62.34 -33.14 74.12 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 177.118 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.503 ' O ' ' HB ' ' A' 1047 ' ' ILE . 3.7 tp -79.08 -22.4 45.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.53 -0.731 . . . . 0.0 110.493 175.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.672 ' HG3' ' HB3' ' A' ' 979' ' ' SER . 13.7 mptt -62.75 -37.0 84.86 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 166.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.42 ' HB3' ' O ' ' A' 1043 ' ' ARG . 22.9 ttt -67.96 -36.11 79.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.373 174.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.503 ' HB ' ' O ' ' A' 1044 ' ' LEU . 27.9 mm -60.65 -43.98 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.91 172.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.578 ' HB3' ' O ' ' A' 1045 ' ' LYS . 35.9 t -47.75 -38.06 14.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.492 174.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -91.82 -53.36 4.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.629 0.252 . . . . 0.0 111.295 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.453 ' OG ' ' HB2' ' A' 1053 ' ' HIS . 26.1 t -128.41 77.42 1.77 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.161 0.505 . . . . 0.0 110.632 -177.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.665 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 58.1 ttt180 -66.53 -56.87 13.72 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.307 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.665 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 16.9 Cg_exo -67.9 -18.8 46.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.216 1.944 . . . . 0.0 113.055 -174.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.453 ' HB2' ' OG ' ' A' 1050 ' ' SER . 28.7 m170 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.296 -0.859 . . . . 0.0 109.942 -177.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.932 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 7.4 tpt180 . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 8.1 p -80.45 39.22 0.45 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -176.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.685 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.4 OUTLIER 47.93 56.81 6.73 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.047 0.939 . . . . 0.0 112.339 172.869 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 925' ' ' VAL . 5.0 p-10 -47.24 -171.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 O-C-N 125.946 2.029 . . . . 0.0 113.632 -175.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.595 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.3 tmtp? -42.04 -8.54 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.568 1.147 . . . . 0.0 113.403 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 1.031 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 2.7 m -73.4 -53.81 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 O-C-N 122.078 -0.389 . . . . 0.0 110.9 174.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.519 ' HD1' ' HB2' ' A' 1040 ' ' ASP . 62.3 t80 -76.69 -28.81 56.05 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.055 0.931 . . . . 0.0 108.829 -172.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.404 ' O ' ' HB ' ' A' ' 930' ' ' THR . 5.3 mm-40 -74.91 -52.27 11.67 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.522 -177.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.595 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 58.1 t30 -73.35 -31.04 63.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -173.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.993 HG12 HD12 ' A' 1039 ' ' ILE . 11.5 p -65.03 -42.22 94.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.596 175.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.669 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 73.6 m -52.0 -30.48 25.38 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-O 120.718 0.294 . . . . 0.0 110.495 166.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -60.83 -31.61 76.47 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.196 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.835 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 1.3 tt -66.92 -41.76 86.53 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.635 ' O ' HG12 ' A' ' 937' ' ' ILE . 40.1 t -63.89 -32.99 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.203 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -73.84 -31.18 63.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.37 0.605 . . . . 0.0 109.434 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.566 ' CB ' ' HB3' ' A' ' 961' ' ' ALA . . . -77.98 -30.39 50.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.141 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.515 HG13 ' HA ' ' A' ' 933' ' ' VAL . 11.5 p -79.15 -12.73 13.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 175.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.635 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -70.1 -38.73 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 165.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.535 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 43.5 mt-10 -61.26 -44.86 96.56 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.416 172.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.571 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 25.2 ttt -56.88 -45.56 82.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.703 176.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 13.7 t -66.45 -34.03 77.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.61 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.647 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 47.6 m -76.46 -28.59 56.59 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.081 0.943 . . . . 0.0 109.245 -177.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.546 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 20.4 mmtm -69.7 -62.31 1.43 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.222 176.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.807 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -59.62 -31.78 47.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.401 -167.689 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.699 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 50.6 mt-30 -73.89 -64.24 0.78 Allowed Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.337 -175.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.8 Cg_endo -90.29 14.73 2.01 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.151 1.234 . . . . 0.0 114.675 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 942' ' ' LYS . . . -127.51 153.61 77.43 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 121.875 -0.516 . . . . 0.0 111.164 175.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.499 ' HB2' ' OE1' ' A' ' 949' ' ' GLU . 4.2 Cg_exo -81.02 176.22 9.12 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.637 2.891 . . . . 0.0 112.629 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.668 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 81.6 Cg_exo -50.97 -32.26 37.6 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.755 2.97 . . . . 0.0 114.792 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.499 ' OE1' ' HB2' ' A' ' 947' ' ' PRO . 1.8 pm0 -55.65 -32.17 62.98 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.904 175.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.61 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER -91.97 -1.91 57.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 176.549 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.727 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.6 m-30 -65.83 -32.89 74.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.993 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -76.17 -51.61 2.67 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 119.129 -1.028 . . . . 0.0 112.046 173.204 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.944 ' HD3' HG13 ' A' ' 952' ' ' VAL . 81.1 Cg_exo -52.99 -30.3 48.17 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.167 1.911 . . . . 0.0 114.897 170.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.807 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.2 ptt? -65.25 -42.29 93.46 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.633 0.73 . . . . 0.0 109.739 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.567 ' HB ' ' HB3' ' A' 1002 ' ' MET . 79.0 t -73.62 -26.3 21.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.913 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.546 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.6 OUTLIER -53.32 -45.75 69.15 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.872 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.8 mm-40 -55.13 -48.59 73.45 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.981 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.464 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 4.1 m -74.01 -28.34 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.45 ' HA2' HD23 ' A' ' 995' ' ' LEU . . . -72.49 -43.53 44.56 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.646 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.45 HD21 ' HD3' ' A' ' 956' ' ' LYS . 4.3 mm? -62.33 -38.74 90.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.185 -0.508 . . . . 0.0 109.674 172.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.835 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -50.18 -55.85 13.46 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 171.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.481 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 2.4 tm? -66.43 -34.86 78.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.111 0.414 . . . . 0.0 110.621 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -56.84 -53.35 58.91 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 122.109 -0.369 . . . . 0.0 111.254 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.403 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 26.3 m -64.35 -40.15 95.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.301 0.572 . . . . 0.0 110.126 177.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.481 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 23.5 tp -53.11 -39.69 63.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.562 172.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.81 -27.7 63.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -65.11 -42.49 93.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 171.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.615 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.3 m -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.729 171.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.817 HG13 HD12 ' A' ' 984' ' ' ILE . 90.4 t -54.49 -30.62 21.89 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.446 174.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.611 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 29.5 t70 -75.89 -26.87 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.512 0.196 . . . . 0.0 111.161 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 975' ' ' VAL . 19.4 mm-40 -70.77 -48.65 53.21 Favored 'General case' 0 C--O 1.247 0.921 0 CA-C-O 122.707 1.242 . . . . 0.0 107.943 173.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.531 ' OG ' HG21 ' A' ' 980' ' ' THR . 35.3 t -69.58 -22.98 63.48 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 114.361 -1.291 . . . . 0.0 110.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 1.081 ' HA ' HD13 ' A' ' 976' ' ' LEU . 1.7 tm? -54.43 -55.29 38.98 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.593 -177.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.611 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.3 Cg_endo -58.05 -26.8 77.01 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 120.749 1.303 . . . . 0.0 110.682 170.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.0 -16.28 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.62 175.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 1.081 HD13 ' HA ' ' A' ' 973' ' ' LEU . 10.8 mp -58.87 -61.37 7.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-O 118.983 -0.532 . . . . 0.0 110.553 173.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.61 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 50.5 Cg_exo -57.05 -31.31 89.82 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 121.68 1.587 . . . . 0.0 111.539 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.402 ' HB3' ' HB2' ' A' 1049 ' ' GLN . . . -61.02 -54.78 40.7 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.77 174.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.775 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -171.11 -37.8 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -176.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.655 HG22 ' HB ' ' A' ' 984' ' ' ILE . 25.2 m -59.27 -22.09 60.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -170.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.585 ' HB3' ' HB3' ' A' ' 976' ' ' LEU . 0.9 OUTLIER -52.66 -20.48 3.12 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -173.085 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -70.51 -55.94 7.75 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.738 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 1.037 ' HB3' HG11 ' A' 1038 ' ' VAL . 0.7 OUTLIER -75.23 -42.87 54.37 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.985 HD11 HD11 ' A' ' 976' ' ' LEU . 18.6 tt -60.85 -36.4 71.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 119.025 -1.07 . . . . 0.0 109.047 -173.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -59.42 -40.63 87.32 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.969 -0.693 . . . . 0.0 111.488 171.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.607 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 8.1 ptp -68.07 -63.25 1.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.588 -177.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.734 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.12 -33.47 50.48 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.404 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 24.4 tm0? -71.51 -41.43 69.24 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.383 0.992 . . . . 0.0 110.0 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -71.14 -23.03 62.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.589 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.3 tp -70.11 -48.79 56.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.092 175.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 79.7 mt -53.6 -43.29 68.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.013 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -50.57 -39.13 48.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.539 173.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 35.8 t -77.34 -50.32 13.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.43 ' CG ' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p30 -72.59 -39.66 67.18 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -174.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.45 HD23 ' HA2' ' A' ' 959' ' ' GLY . 2.0 tm? -56.88 -48.15 78.84 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 171.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.766 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -52.12 -26.48 11.35 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 171.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.671 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 5.2 mm-40 -79.08 -34.91 43.21 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.525 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.877 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 10.3 mp -80.22 -32.09 38.51 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.857 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.766 HG12 ' HA ' ' A' ' 996' ' ' ALA . 44.3 pt -68.94 -20.42 24.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.779 175.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.671 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 1.6 p30 -95.99 -17.37 21.05 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.877 ' HB3' ' HA ' ' A' ' 998' ' ' LEU . 37.2 tptt -65.86 -40.77 91.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.152 0.501 . . . . 0.0 109.906 168.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.993 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.0 ptt? -78.29 -34.42 48.82 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.866 ' O ' ' HB2' ' A' 1007 ' ' GLN . 27.1 tttp -61.42 -56.81 16.1 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.044 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.463 HD22 ' HA ' ' A' 1004 ' ' LEU . 14.0 mt -66.4 -48.32 70.48 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.884 -172.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.77 -47.91 84.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.41 0.624 . . . . 0.0 110.481 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.44 59.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.528 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.866 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.9 tp-100 -80.78 -43.14 20.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.3 0.571 . . . . 0.0 110.062 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.639 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 14.5 m-85 -106.18 24.07 13.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.375 -178.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.472 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 3.3 p -52.95 85.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 121.995 0.903 . . . . 0.0 110.829 173.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.515 ' H ' ' HB2' ' A' 1014 ' ' GLN . 16.2 tpt -152.68 105.97 3.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.48 -177.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 40.0 p 39.54 -110.1 0.09 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 124.426 1.079 . . . . 0.0 113.884 172.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 6.1 m -92.7 -22.22 19.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.511 -172.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.402 HD13 ' N ' ' A' 1013 ' ' LEU . 6.7 mp -71.81 -29.8 64.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.052 0.454 . . . . 0.0 110.116 -177.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.732 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.7 OUTLIER -57.99 -48.89 78.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.221 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.529 ' N ' HE21 ' A' 1015 ' ' GLN . 0.0 OUTLIER -53.78 -34.71 59.94 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.138 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.478 ' HG3' ' N ' ' A' 1017 ' ' TYR . 0.4 OUTLIER -49.49 -59.56 3.64 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.52 1.152 . . . . 0.0 110.236 171.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HD2' ' A' 1008 ' ' TYR . 86.8 m-85 -69.04 -29.95 68.21 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.031 -1.895 . . . . 0.0 110.928 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.732 ' HB2' HE22 ' A' 1014 ' ' GLN . 81.4 tttt -58.15 -46.91 84.86 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.253 165.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -76.72 -59.59 2.71 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.046 0.451 . . . . 0.0 112.058 -172.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -57.81 -46.31 84.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.19 -176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.863 ' HE3' ' HA ' ' A' 1021 ' ' MET . 20.4 mmt -74.73 -17.66 60.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.344 -177.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' 1018 ' ' LYS . 34.6 tp -70.92 -30.87 67.32 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 22.4 m -65.39 -38.66 90.67 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.664 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.351 174.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.734 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -63.9 -34.84 78.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.869 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.452 ' O ' HG21 ' A' 1030 ' ' VAL . 40.2 t-80 -68.47 -31.32 70.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.719 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.49 43.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.659 HD23 HD23 ' A' ' 998' ' ' LEU . 0.3 OUTLIER -56.21 -48.35 76.6 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.049 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.52 ' N ' HD21 ' A' 1028 ' ' LEU . . . -54.2 -33.11 57.44 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.459 ' O ' ' HB3' ' A' 1033 ' ' LYS . 85.1 t -84.13 -38.61 14.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.994 0.426 . . . . 0.0 111.027 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.544 ' OD1' HD23 ' A' ' 990' ' ' LEU . 66.2 m-20 -72.7 -29.32 63.28 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.983 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.492 ' HB2' HD11 ' A' ' 932' ' ' LEU . . . -52.62 -55.2 24.07 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 161.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.645 ' O ' ' HB3' ' A' 1036 ' ' LEU . 5.0 tmmm? -52.31 -29.45 23.45 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 172.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.452 ' O ' HG22 ' A' 1038 ' ' VAL . 60.5 t30 -68.13 -48.32 65.72 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.41 -0.806 . . . . 0.0 109.193 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.818 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 10.3 tp -64.18 -32.49 74.08 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.88 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.928 ' HA ' HG12 ' A' ' 929' ' ' VAL . 3.0 tm? -48.65 -32.15 7.82 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.88 0.872 . . . . 0.0 109.781 173.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.597 ' O ' ' HG3' ' A' 1041 ' ' GLN . 22.3 t70 -92.74 -35.96 13.17 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.821 178.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 1.037 HG11 ' HB3' ' A' ' 983' ' ' GLU . 38.1 t -55.92 -62.21 0.9 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.215 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 1.031 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -75.94 -33.33 25.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.923 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.953 ' H ' HD13 ' A' 1039 ' ' ILE . 26.5 t70 -54.76 -31.37 58.55 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.47 162.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.8 ' HB3' ' HE2' ' A' 1045 ' ' LYS . 50.5 mt-30 -77.5 -33.76 54.32 Favored 'General case' 0 C--O 1.206 -1.232 0 C-N-CA 118.964 -1.094 . . . . 0.0 108.25 171.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.639 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.86 -53.07 60.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.571 0.544 . . . . 0.0 110.679 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.932 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.76 -42.79 17.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.404 172.072 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.492 ' N ' ' HD3' ' A' 1043 ' ' ARG . 60.3 tp -79.4 -28.94 41.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.644 0.259 . . . . 0.0 111.398 177.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.8 ' HE2' ' HB3' ' A' 1041 ' ' GLN . 73.0 mmtt -60.31 -43.85 95.97 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.859 0.838 . . . . 0.0 109.267 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.592 ' HG2' ' HD2' ' A' 1052 ' ' PRO . 18.8 ttt -62.99 -36.33 83.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.347 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.874 HD13 ' HB2' ' A' ' 920' ' ' ARG . 39.3 mm -62.15 -49.96 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.509 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 39.1 t -52.35 -40.05 61.48 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.631 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.402 ' HB2' ' HB3' ' A' ' 978' ' ' ALA . 48.7 tp60 -62.76 -67.89 0.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.7 m -160.36 5.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.418 ' HD3' HD11 ' A' 1047 ' ' ILE . 8.7 tpt180 52.82 71.72 1.37 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 109.933 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.592 ' HD2' ' HG2' ' A' 1046 ' ' MET . 4.8 Cg_exo -82.02 41.84 1.2 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 123.561 2.841 . . . . 0.0 112.403 -178.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 10.9 t60 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.417 -0.802 . . . . 0.0 109.433 179.487 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.558 ' HB2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.421 0.629 . . . . 0.0 111.373 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 16.8 p -112.25 19.35 17.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.097 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.45 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.44 53.97 11.98 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.505 -174.227 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.597 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 29.8 t70 -47.33 -175.31 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 O-C-N 125.834 1.959 . . . . 0.0 112.268 -173.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.498 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.6 tmtp? -35.51 -24.09 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 124.294 1.038 . . . . 0.0 112.024 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.813 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.1 m -59.23 -52.41 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.297 175.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -76.96 -21.27 55.01 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 122.122 0.963 . . . . 0.0 108.975 -177.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -79.31 -54.59 5.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.087 -174.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HE2' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.63 -32.54 68.08 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.812 -177.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.993 HG12 ' HA ' ' A' 1036 ' ' LEU . 9.8 p -63.71 -38.34 82.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.476 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.538 ' CG2' HD11 ' A' 1036 ' ' LEU . 7.7 p -70.17 -28.3 65.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.4 -30.59 65.01 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.335 171.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.968 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 4.2 tt -68.08 -48.73 64.74 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.588 ' O ' HG12 ' A' ' 937' ' ' ILE . 36.0 t -57.51 -44.63 85.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 110.343 174.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.462 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 0.0 OUTLIER -59.04 -32.18 69.52 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.043 176.598 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.618 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.7 -26.63 40.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.583 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.624 ' O ' ' HB3' ' A' ' 939' ' ' MET . 14.7 p -83.49 -12.56 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.035 171.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 933' ' ' VAL . 46.0 mm -73.83 -39.07 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 164.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.618 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.6 mm-40 -52.57 -33.8 47.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.314 169.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.956 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 32.5 ttm -60.03 -45.82 91.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.974 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.565 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 48.8 m -68.25 -30.05 69.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.173 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.671 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.6 m -76.49 -33.8 58.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.824 0.821 . . . . 0.0 109.008 -177.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.606 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 19.5 mmtt -60.09 -50.47 73.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.195 -1.366 . . . . 0.0 112.28 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . . . . . . . . . 6.8 tp -69.67 -23.69 26.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.049 -176.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.712 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.9 mt-30 -52.68 -61.73 4.28 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.712 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 73.6 Cg_endo -99.62 10.0 0.72 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.783 1.656 . . . . 0.0 115.148 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 950' ' ' GLU . . . -139.24 159.67 65.34 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 118.885 0.766 . . . . 0.0 112.844 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.702 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 1.5 Cg_endo -83.5 173.92 9.25 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.859 3.039 . . . . 0.0 111.569 174.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 91.4 Cg_exo -48.4 -16.29 0.66 Allowed 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 124.264 3.309 . . . . 0.0 115.277 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -54.43 -18.5 4.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.21 169.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.702 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.0 OUTLIER -95.4 -15.42 23.04 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.655 175.189 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.5 ' HB2' ' O ' ' A' ' 948' ' ' PRO . 5.8 m-30 -49.38 -44.14 44.69 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.566 0.698 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.09 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.1 OUTLIER -69.84 -56.66 7.31 Favored Pre-proline 0 CA--C 1.555 1.169 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.134 177.617 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.946 ' HD3' HG11 ' A' ' 952' ' ' VAL . 83.5 Cg_exo -55.71 -35.08 92.61 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.509 2.139 . . . . 0.0 114.964 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.956 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 24.6 ptt? -65.41 -42.18 92.83 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.798 -0.563 . . . . 0.0 110.091 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.648 ' CG2' ' HB3' ' A' 1002 ' ' MET . 74.7 t -67.41 -28.6 42.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.996 170.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.5 tmpt? -60.29 -40.15 89.44 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 33.5 mm-40 -54.37 -45.97 72.93 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.423 174.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.592 ' O ' ' HB2' ' A' ' 961' ' ' ALA . 1.8 t -75.73 -29.6 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.19 -44.09 77.5 Favored Glycine 0 N--CA 1.455 -0.09 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.829 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.446 HD23 ' HE3' ' A' ' 956' ' ' LYS . 11.0 mp -64.52 -21.29 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 110.574 171.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.968 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -63.2 -53.05 59.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.565 177.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.663 ' HB3' HD23 ' A' ' 995' ' ' LEU . 2.7 tm? -72.51 -28.8 63.1 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.121 177.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 -54.69 -59.59 4.51 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.756 -0.59 . . . . 0.0 111.717 170.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 17.2 p -55.87 -37.73 69.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.235 0.54 . . . . 0.0 110.559 175.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.733 HD22 HD22 ' A' 1035 ' ' LEU . 23.8 tp -65.85 -27.88 68.56 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.994 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 49.3 tp -64.71 -34.45 78.34 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.65 90.71 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.576 0.703 . . . . 0.0 109.714 173.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.813 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 4.1 m -66.97 -39.68 87.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.04 173.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.641 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 70.8 t -54.62 -37.24 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.497 174.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 35.0 t70 -71.8 -22.77 61.52 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.528 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 20.3 mm-40 -65.74 -52.93 47.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 123.187 1.47 . . . . 0.0 108.06 168.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.552 ' OG ' HG23 ' A' ' 980' ' ' THR . 42.3 t -66.06 -25.43 67.03 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.291 -1.777 . . . . 0.0 111.855 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.649 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 53.7 mt -61.35 -51.01 80.88 Favored Pre-proline 0 C--O 1.214 -0.798 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.921 -177.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.566 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 57.2 Cg_exo -56.64 -30.05 82.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 121.567 1.595 . . . . 0.0 111.075 168.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' 1042 ' ' ALA . 3.2 t -75.6 -13.36 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.827 176.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.649 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.9 tt -64.35 -55.47 30.36 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.566 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 51.9 Cg_exo -56.72 -32.26 90.52 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.61 1.54 . . . . 0.0 111.37 174.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.18 -65.05 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.012 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.761 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.1 m -157.99 -36.76 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.78 HG21 ' HB ' ' A' ' 984' ' ' ILE . 4.9 m -55.43 -18.48 7.04 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -174.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.639 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 16.1 p-80 -48.78 -20.19 0.45 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 79.7 mtt180 -78.11 -55.39 5.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.077 0.942 . . . . 0.0 110.154 175.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.861 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.71 -45.77 23.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.389 -175.023 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.78 ' HB ' HG21 ' A' ' 980' ' ' THR . 8.7 tp -56.78 -34.05 42.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.469 -172.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 0.0 OUTLIER -74.45 -34.5 63.19 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.165 179.279 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.66 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.0 ptp -60.75 -56.4 21.69 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 119.958 -0.697 . . . . 0.0 112.294 -174.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.573 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.62 -33.71 41.23 Favored 'General case' 0 C--O 1.209 -1.042 0 O-C-N 122.262 -0.274 . . . . 0.0 110.973 -176.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 1.077 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.6 tt0 -61.12 -46.09 92.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.099 0.475 . . . . 0.0 110.889 -176.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.6 -31.48 72.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.71 175.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.682 ' HG ' ' OD1' ' A' 1031 ' ' ASP . 5.7 tp -75.19 -32.9 61.35 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.653 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.077 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.2 mt -63.58 -48.44 77.39 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.199 0.523 . . . . 0.0 110.053 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -58.06 -38.27 75.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.451 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 4.6 t -60.75 -49.86 75.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.059 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.02 -27.82 10.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.678 -0.809 . . . . 0.0 113.103 -165.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.812 HD12 HD21 ' A' 1028 ' ' LEU . 5.7 tp -56.86 -48.03 79.06 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 167.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -58.09 -46.66 85.12 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.513 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' 1001 ' ' LYS . 10.3 mm-40 -62.81 -36.65 83.87 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.241 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.646 ' HG ' HG13 ' A' ' 955' ' ' VAL . 47.0 tp -66.82 -33.4 75.53 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 995' ' ' LEU . 75.9 mt -61.53 -35.97 70.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.897 175.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.656 ' O ' ' HB2' ' A' 1004 ' ' LEU . 49.1 m-80 -89.22 -6.61 56.73 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.526 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.691 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 67.1 mmtt -86.58 -36.33 18.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 174.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.09 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -70.87 -38.12 73.09 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.458 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.802 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.0 tttm -60.37 -54.24 47.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.224 -1.353 . . . . 0.0 108.889 172.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.736 ' HG ' ' CD2' ' A' 1017 ' ' TYR . 14.9 tp -57.89 -48.22 80.49 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.53 90.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.336 0.589 . . . . 0.0 110.426 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.506 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pt20 -76.34 -12.12 60.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.565 0.697 . . . . 0.0 109.8 178.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.802 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -81.67 -28.08 33.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.07 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.51 11.96 13.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.63 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.581 ' HA ' ' HG2' ' A' 1014 ' ' GLN . 8.2 p -47.36 106.71 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.469 -175.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.433 ' HG2' HD13 ' A' 1013 ' ' LEU . 53.0 tpp -153.2 129.65 10.64 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.046 176.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 7.3 t -48.19 128.84 14.7 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.316 0.385 . . . . 0.0 111.441 -178.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.8 m 76.3 -46.53 0.53 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.052 176.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.433 HD13 ' HG2' ' A' 1010 ' ' MET . 93.9 mt -72.83 -26.05 61.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.709 0.29 . . . . 0.0 111.211 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.92 -32.53 61.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.682 -179.421 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.716 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.8 tt0 -56.13 -31.03 62.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.556 -171.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -51.35 -57.34 9.17 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.214 0.531 . . . . 0.0 110.531 171.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.736 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.0 m-30 -73.81 -23.52 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.703 178.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.716 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 62.2 tttp -64.43 -44.65 90.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.24 178.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' 1015 ' ' GLN . 97.3 mttt -59.53 -56.58 20.22 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.987 0.422 . . . . 0.0 109.946 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -50.89 -40.33 56.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.531 174.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.66 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 19.6 ttt -62.43 -52.21 64.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.4 tp -61.93 -35.24 77.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 40.1 m -63.76 -34.34 77.68 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.156 0.503 . . . . 0.0 110.811 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.658 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -79.7 -39.07 32.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.337 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -59.75 -43.85 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.144 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.46 ' O ' HG23 ' A' 1030 ' ' VAL . 56.6 t60 -59.48 -36.24 75.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.379 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.4 65.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 995' ' ' LEU . 5.0 tp -73.11 -32.0 64.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 178.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.95 -49.87 75.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.17 173.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' 1026 ' ' HIS . 99.2 t -69.17 -19.95 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 121.664 0.745 . . . . 0.0 110.622 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.791 ' OD2' ' HA ' ' A' ' 991' ' ' LEU . 0.6 OUTLIER -76.65 -43.79 36.67 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.031 177.25 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.613 ' HB2' HD21 ' A' ' 932' ' ' LEU . . . -57.13 -42.15 80.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -63.93 -33.94 76.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.975 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.641 ' O ' HG22 ' A' 1038 ' ' VAL . 65.6 t30 -67.38 -43.69 80.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.858 HD21 HD11 ' A' ' 991' ' ' LEU . 16.3 tp -75.7 -24.39 56.24 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.993 ' HA ' HG12 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -63.2 -32.67 74.12 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 120.876 0.369 . . . . 0.0 110.427 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.575 ' N ' HD22 ' A' 1036 ' ' LEU . 32.2 t70 -86.7 -36.9 18.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.861 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 25.4 t -52.82 -63.15 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.354 176.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.878 HD13 ' HB ' ' A' ' 929' ' ' VAL . 4.4 pt -81.54 -28.63 10.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.188 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -51.7 -48.41 63.55 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 163.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.696 ' O ' ' HG2' ' A' 1045 ' ' LYS . 41.8 mt-30 -71.75 -25.94 62.25 Favored 'General case' 0 C--O 1.203 -1.35 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.224 177.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.699 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -52.7 -54.68 30.18 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 118.177 0.444 . . . . 0.0 110.969 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.597 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 2.0 mpt_? -55.35 -32.96 62.98 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.138 174.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.502 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 55.2 tp -72.61 -37.05 68.21 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.874 174.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.761 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 68.5 mmtt -58.88 -33.44 70.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.454 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 27.1 ttt -73.07 -37.16 66.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.576 -178.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.418 HG12 ' O ' ' A' 1043 ' ' ARG . 51.4 mm -61.16 -45.77 97.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.2 t -56.47 -60.25 3.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.243 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -87.47 -55.52 3.76 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -174.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' 1046 ' ' MET . 21.4 t -66.85 -44.3 81.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.946 -173.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 63.05 106.64 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-O 121.394 0.616 . . . . 0.0 111.382 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -82.18 35.36 0.58 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.258 2.639 . . . . 0.0 113.517 -173.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 47.3 t60 . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.462 -0.78 . . . . 0.0 109.923 -179.485 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.557 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 36.0 m -86.91 26.45 1.14 Allowed 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.997 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.557 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.6 62.17 2.3 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.11 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.621 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 6.5 t0 -46.01 -176.17 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 125.733 1.895 . . . . 0.0 112.702 -173.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.511 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.8 tmtp? -36.59 -24.82 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 124.236 1.014 . . . . 0.0 111.914 177.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.833 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.1 m -58.63 -52.3 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.104 175.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.428 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 64.1 t80 -75.92 -24.66 55.56 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -176.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 31.1 mt-10 -70.51 -55.9 7.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.544 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.521 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 0.2 OUTLIER -73.77 -32.89 64.01 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.468 -176.586 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.93 HG12 ' HA ' ' A' 1036 ' ' LEU . 5.5 p -62.84 -35.83 72.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.294 176.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.66 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 6.5 p -72.43 -32.71 66.54 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.79 -31.28 67.47 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.35 172.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.617 ' O ' HG11 ' A' ' 936' ' ' VAL . 2.8 tp -62.0 -46.79 87.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 173.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.528 ' O ' HG23 ' A' ' 936' ' ' VAL . 61.3 t -62.8 -37.78 80.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.907 0.384 . . . . 0.0 110.442 174.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.4 mmpt? -62.47 -31.97 72.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.388 0.613 . . . . 0.0 109.784 176.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.687 ' HB2' ' HB2' ' A' ' 961' ' ' ALA . . . -81.61 -24.6 36.31 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.561 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.734 ' O ' ' HG2' ' A' ' 939' ' ' MET . 1.6 m -79.61 -10.76 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 C-N-CA 119.211 -0.996 . . . . 0.0 109.358 172.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.525 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 67.0 mt -73.86 -30.54 28.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 167.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.571 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 7.5 mm-40 -55.21 -47.42 75.32 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.001 170.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.734 ' HG2' ' O ' ' A' ' 936' ' ' VAL . 11.5 ptt? -62.19 -40.6 96.6 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.283 0.364 . . . . 0.0 110.604 -175.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.692 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.5 p -68.9 -31.55 70.54 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.568 0.223 . . . . 0.0 111.27 -178.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.686 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.8 m -80.08 -42.75 23.05 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.5 tppp? -59.67 -39.34 84.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 113.268 -1.787 . . . . 0.0 111.479 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.775 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -73.64 -31.98 33.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 121.321 -0.152 . . . . 0.0 110.975 -179.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.1 mt-30 -49.91 -61.84 3.2 Favored Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.686 ' HD3' ' O ' ' A' ' 941' ' ' SER . 93.7 Cg_endo -99.12 16.1 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.09 1.86 . . . . 0.0 113.42 -172.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.934 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -116.39 151.84 47.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.455 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 5.4 Cg_exo -80.91 -179.63 5.26 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.766 2.978 . . . . 0.0 110.516 170.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.545 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 10.2 Cg_endo -53.41 -24.88 29.45 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.804 2.336 . . . . 0.0 113.063 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.461 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 36.3 mt-10 -57.17 -44.11 83.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.718 178.113 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.934 ' HB2' ' HB3' ' A' ' 946' ' ' ALA . 1.9 mp0 -94.03 1.09 56.27 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.569 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.601 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.6 m-85 -58.12 -45.56 87.07 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 170.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.067 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -72.33 -47.01 10.54 Favored Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 119.502 -0.879 . . . . 0.0 112.293 176.127 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.067 ' HD3' HG13 ' A' ' 952' ' ' VAL . 80.4 Cg_exo -51.47 -30.78 36.41 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 122.093 1.862 . . . . 0.0 115.108 171.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.775 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 2.4 ptt? -64.62 -46.02 84.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.95 -1.1 . . . . 0.0 108.653 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.665 ' N ' ' HG3' ' A' ' 954' ' ' MET . 0.3 OUTLIER -64.33 -25.06 37.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.777 173.827 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.495 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.4 ttmm -61.85 -37.59 85.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 176.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -59.35 -46.73 87.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.863 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 955' ' ' VAL . 9.0 m -65.5 -28.16 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.605 176.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.82 64.47 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.179 -1.01 . . . . 0.0 111.921 178.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.38 -36.63 71.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.95 0.405 . . . . 0.0 110.24 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.687 ' HB2' ' HB2' ' A' ' 935' ' ' ALA . . . -56.9 -56.04 26.73 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.792 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.524 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 30.6 tp -63.08 -35.5 80.47 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.649 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.48 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 52.1 mtm-85 -62.73 -48.95 77.02 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.272 176.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.496 HG21 ' OD1' ' A' ' 928' ' ' ASN . 5.5 m -56.08 -39.05 71.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.773 0.797 . . . . 0.0 109.792 172.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.547 HD22 HD21 ' A' ' 932' ' ' LEU . 64.8 tp -62.48 -27.66 69.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.974 176.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 86.1 mt -64.77 -28.94 69.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.331 178.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.84 -40.93 97.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.249 0.547 . . . . 0.0 109.713 172.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.757 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.5 m -61.46 -43.74 98.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.57 172.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.523 HG12 HD11 ' A' ' 984' ' ' ILE . 91.2 t -54.88 -31.42 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.157 177.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 14.9 t70 -75.78 -26.3 57.21 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.573 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 57.1 mm-40 -70.66 -49.15 50.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 122.709 1.242 . . . . 0.0 108.92 171.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.618 ' OG ' HG22 ' A' ' 980' ' ' THR . 43.3 t -68.28 -24.69 64.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.67 -1.604 . . . . 0.0 111.649 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.706 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 3.8 tt -61.43 -51.45 77.38 Favored Pre-proline 0 C--O 1.218 -0.591 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.614 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.61 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.4 Cg_exo -59.82 -27.35 84.73 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 121.09 1.425 . . . . 0.0 111.214 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.553 HG21 ' O ' ' A' ' 971' ' ' GLU . 2.7 t -78.24 -11.8 13.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.318 175.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.85 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.8 tt -65.64 -54.86 26.98 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.207 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.539 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 28.3 Cg_endo -64.84 -23.53 62.28 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.302 1.334 . . . . 0.0 111.186 174.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.94 -60.38 3.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.375 172.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.789 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.3 m -165.35 -34.43 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -177.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.821 HG23 ' HB ' ' A' ' 984' ' ' ILE . 22.0 m -55.83 -19.91 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -172.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.85 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 11.7 p-80 -49.74 -21.15 0.99 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.891 0.701 . . . . 0.0 112.891 -173.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -73.98 -52.96 11.14 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.672 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 1.018 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.75 -43.38 30.99 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.202 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.821 ' HB ' HG23 ' A' ' 980' ' ' THR . 0.0 OUTLIER -58.27 -34.75 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -173.316 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -73.81 -32.4 63.72 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.657 175.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.783 ' HE2' ' HG3' ' A' ' 983' ' ' GLU . 12.0 ptt? -69.14 -54.44 14.89 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.564 -175.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.67 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.08 -33.92 38.45 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.985 ' HA ' HD12 ' A' ' 991' ' ' LEU . 53.3 tp60 -59.37 -46.42 88.69 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.258 0.481 . . . . 0.0 111.049 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -67.76 -25.69 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.505 0.669 . . . . 0.0 109.965 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 1.7 tp -73.25 -42.33 62.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.305 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.985 HD12 ' HA ' ' A' ' 988' ' ' GLN . 10.3 mt -58.57 -49.15 78.48 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 121.365 0.602 . . . . 0.0 109.897 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.424 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 10.2 t30 -55.73 -41.08 73.35 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.545 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.6 t -69.48 -43.09 73.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.61 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.418 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 35.7 m-20 -95.63 -41.0 9.12 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.195 -0.602 . . . . 0.0 112.383 -169.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.017 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.38 -53.13 61.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 175.317 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 992' ' ' ASN . . . -60.6 -48.58 81.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.439 -177.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.0 pt-20 -64.34 -32.02 73.45 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 118.949 -1.1 . . . . 0.0 111.414 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.716 HD22 HD11 ' A' 1028 ' ' LEU . 54.9 tp -64.48 -38.27 90.43 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.852 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.544 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 76.8 mt -55.59 -39.22 53.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.401 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.683 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 33.8 m-80 -95.49 -5.27 43.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.004 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 15.8 tptp -83.35 -44.39 14.91 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.903 ' HE3' ' HG3' ' A' 1021 ' ' MET . 40.0 tpp -78.51 -31.14 47.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.947 173.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.769 ' O ' ' HB2' ' A' 1007 ' ' GLN . 83.3 tttt -58.34 -49.21 77.99 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 171.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1004 ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.33 -37.29 82.73 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.405 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -67.63 -44.8 77.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.381 0.61 . . . . 0.0 110.69 178.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.424 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -74.26 -9.72 58.89 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.229 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.769 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.7 OUTLIER -91.53 -10.5 40.48 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.124 -0.943 . . . . 0.0 109.718 175.646 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 26.1 t80 -123.82 12.19 9.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.271 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.571 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 7.1 p -58.76 95.47 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.989 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 25.4 mmt -121.6 3.77 10.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.402 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 60.1 m 68.28 131.27 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.426 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 23.1 t 71.29 -60.61 0.51 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.048 0.539 . . . . 0.0 109.919 -174.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.7 -28.18 68.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.291 0.567 . . . . 0.0 109.578 174.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.589 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? -60.77 -38.65 85.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.884 177.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.524 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 46.5 mt-30 -67.42 -30.68 70.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.779 -175.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.58 -47.44 57.95 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.675 169.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.405 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.6 m-30 -77.42 -24.71 50.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.776 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.589 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 83.9 tttt -72.44 -37.21 68.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.754 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -66.77 -50.81 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -46.86 -40.99 14.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.271 170.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.903 ' HG3' ' HE3' ' A' 1002 ' ' MET . 14.3 tmm? -61.46 -43.15 99.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.443 177.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.6 -42.0 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.755 0.312 . . . . 0.0 111.089 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 12.5 m -63.36 -36.4 83.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.064 0.459 . . . . 0.0 110.551 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.25 -36.23 47.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.814 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.628 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -65.1 -31.87 73.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.628 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.548 ' O ' HG23 ' A' 1030 ' ' VAL . 61.4 t60 -72.1 -46.38 56.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.109 176.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.79 85.97 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.088 0.471 . . . . 0.0 109.981 177.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 1.017 HD13 ' HA ' ' A' ' 995' ' ' LEU . 2.0 tt -58.74 -51.77 68.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.557 172.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.82 65.38 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.712 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' 1026 ' ' HIS . 84.5 t -66.4 -33.81 65.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 174.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.655 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.1 p30 -71.89 -41.92 67.39 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -55.81 -50.37 70.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 0.0 110.025 171.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' 1036 ' ' LEU . 13.3 tptm -66.5 -37.17 84.49 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.921 -1.036 . . . . 0.0 112.005 -174.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.566 ' O ' HG22 ' A' 1038 ' ' VAL . 60.4 t30 -75.71 -35.11 60.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.412 -174.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 7.0 tp -77.67 -30.04 51.8 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.93 ' HA ' HG12 ' A' ' 929' ' ' VAL . 6.4 tt -48.77 -41.67 33.16 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.698 0.761 . . . . 0.0 109.538 172.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -75.71 -46.74 29.47 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.205 174.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 1.018 HG12 ' HB3' ' A' ' 983' ' ' GLU . 17.7 t -48.02 -58.91 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.833 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.6 pp -83.44 -30.46 8.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.798 ' H ' HD12 ' A' 1039 ' ' ILE . 5.5 t0 -56.94 -42.48 80.14 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 165.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.706 ' O ' ' HG2' ' A' 1045 ' ' LYS . 55.0 mt-30 -75.12 -23.62 57.93 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-N 114.332 -1.304 . . . . 0.0 110.837 174.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.693 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -54.38 -55.36 29.4 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 118.818 0.735 . . . . 0.0 110.721 171.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.621 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 0.9 OUTLIER -58.66 -27.67 64.98 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.703 173.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.558 HD21 ' O ' ' A' 1044 ' ' LEU . 5.8 tt -75.35 -32.87 61.0 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.018 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.795 ' HG3' ' HA ' ' A' ' 980' ' ' THR . 74.1 mmtt -61.39 -30.28 70.45 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 175.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.408 ' HG2' ' HG3' ' A' 1052 ' ' PRO . 24.5 ttt -77.23 -30.26 54.48 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.931 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.567 ' HA ' ' HA ' ' A' 1051 ' ' ARG . 48.5 mm -65.36 -46.55 90.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 169.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 52.4 m -55.67 -37.54 68.43 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.972 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -60.03 -71.15 0.14 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.341 175.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.631 ' O ' ' HG2' ' A' 1051 ' ' ARG . 18.7 m -153.66 -2.24 0.21 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.913 177.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' 1050 ' ' SER . 5.4 ptp180 61.18 124.46 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 124.065 0.946 . . . . 0.0 110.969 -170.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 12.6 Cg_exo -68.8 148.25 70.75 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.964 2.443 . . . . 0.0 112.717 -174.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.245 0.835 0 CA-C-O 118.57 -0.729 . . . . 0.0 109.048 174.717 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 1.024 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 21.1 t -97.78 25.55 5.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.175 0.512 . . . . 0.0 109.728 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.11 62.33 2.72 Favored 'General case' 0 CA--C 1.498 -1.045 0 CA-C-O 122.129 0.966 . . . . 0.0 109.479 -176.399 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.514 ' HB2' ' HG3' ' A' 1043 ' ' ARG . 29.4 m-20 -44.62 -171.6 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 110.77 -2.923 . . . . 0.0 113.547 -176.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.491 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 1.2 tmtm? -38.09 -17.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.883 0.873 . . . . 0.0 112.865 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.98 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 15.8 m -65.05 -52.97 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 O-C-N 122.155 -0.341 . . . . 0.0 111.719 177.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.492 ' N ' HG23 ' A' ' 925' ' ' VAL . 46.4 t80 -75.89 -22.3 56.27 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -174.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -74.52 -61.64 1.8 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.209 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.43 ' OD1' HG21 ' A' ' 964' ' ' THR . 0.2 OUTLIER -65.96 -31.79 72.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.806 -173.972 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.738 HG11 ' HA ' ' A' 1036 ' ' LEU . 11.0 p -65.25 -43.42 95.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.605 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 18.4 p -71.21 -25.17 62.4 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.77 -27.95 62.39 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.028 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.905 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 4.8 tt -65.56 -46.43 79.52 Favored 'General case' 0 CA--C 1.523 -0.065 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 172.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.613 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.1 t -58.71 -41.71 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.644 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.605 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.7 OUTLIER -65.49 -27.69 68.67 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.061 0.457 . . . . 0.0 110.972 177.596 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.55 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -81.28 -26.17 35.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.198 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.568 ' HA ' HG11 ' A' ' 958' ' ' VAL . 13.3 p -82.96 -12.49 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.638 0.733 . . . . 0.0 109.489 172.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.613 HG12 ' O ' ' A' ' 933' ' ' VAL . 49.4 mm -66.95 -34.6 71.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.55 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.8 mt-10 -62.18 -47.53 84.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.063 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.59 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.8 ttp -55.57 -39.74 71.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.19 176.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 13.3 t -61.93 -38.2 87.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.07 0.462 . . . . 0.0 110.546 178.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.0 m -78.24 -40.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.165 0.983 . . . . 0.0 108.597 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.723 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 5.9 tmtp? -67.86 -34.94 77.66 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.278 -177.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.516 ' O ' HD11 ' A' ' 943' ' ' ILE . 0.0 OUTLIER -73.4 -28.4 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.281 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.662 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 74.5 mt-30 -49.7 -54.24 33.59 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.624 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.662 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.6 Cg_endo -99.63 21.43 0.26 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.94 1.76 . . . . 0.0 113.37 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -94.95 130.11 33.79 Favored Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -171.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 92.9 Cg_endo -85.31 -179.31 3.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.034 2.489 . . . . 0.0 108.94 158.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.748 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 73.5 Cg_exo -51.07 -33.7 44.21 Favored 'Trans proline' 0 C--O 1.241 0.647 0 C-N-CA 122.048 1.832 . . . . 0.0 112.089 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.529 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 5.0 mp0 -55.07 -42.24 72.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.244 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.648 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 29.7 mm-40 -94.86 -5.8 44.19 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.468 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.748 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 12.1 m-30 -59.82 -37.32 78.84 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.906 HG11 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -73.3 -53.47 4.71 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 120.282 -0.567 . . . . 0.0 112.054 176.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.906 ' HD3' HG11 ' A' ' 952' ' ' VAL . 63.6 Cg_exo -56.65 -31.57 87.78 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.033 1.822 . . . . 0.0 114.454 175.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.59 ' HG3' ' HG3' ' A' ' 939' ' ' MET . 18.4 ptt? -68.42 -36.71 79.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.232 1.015 . . . . 0.0 109.592 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.953 HG12 ' HA ' ' A' ' 999' ' ' ILE . 84.3 t -71.87 -25.41 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.868 174.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.552 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 59.4 tttp -56.24 -39.51 72.67 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.75 -48.17 75.73 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.032 175.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 936' ' ' VAL . 3.8 m -76.52 -22.82 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-O 120.944 0.402 . . . . 0.0 112.017 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.55 -42.17 64.11 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.675 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.25 -24.57 63.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.91 0.386 . . . . 0.0 110.004 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.905 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -57.0 -56.39 22.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.62 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.588 HD12 HD13 ' A' ' 991' ' ' LEU . 53.7 tp -72.4 -31.5 65.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.199 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.46 ' C ' ' HD3' ' A' ' 963' ' ' ARG . 3.3 tmt_? -61.54 -53.67 53.34 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.43 HG21 ' OD1' ' A' ' 928' ' ' ASN . 15.7 m -59.14 -32.34 69.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.301 0.572 . . . . 0.0 110.526 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.814 HD13 HD11 ' A' ' 932' ' ' LEU . 0.5 OUTLIER -63.79 -41.67 97.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.937 177.254 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 96.6 mt -53.04 -31.22 40.22 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.317 174.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -49.61 74.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.415 0.626 . . . . 0.0 109.795 173.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.83 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -56.2 -46.23 79.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.629 170.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.451 HG13 HD12 ' A' ' 984' ' ' ILE . 90.4 t -53.36 -30.81 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.81 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 13.0 t70 -70.6 -33.1 70.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.325 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.576 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.8 mm-40 -60.49 -54.59 43.73 Favored 'General case' 0 C--O 1.247 0.946 0 CA-C-O 122.603 1.192 . . . . 0.0 108.46 171.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 40.0 t -55.61 -26.82 46.12 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 114.224 -1.353 . . . . 0.0 112.129 174.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 1.039 ' HA ' HD13 ' A' ' 976' ' ' LEU . 7.0 tt -57.99 -53.85 61.57 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-O 118.7 -0.666 . . . . 0.0 111.743 -174.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.621 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.8 Cg_exo -54.87 -26.99 51.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 CA-C-N 120.857 1.342 . . . . 0.0 111.25 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.716 HG11 ' HB2' ' A' 1046 ' ' MET . 3.8 t -78.3 -17.32 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 120.073 -0.651 . . . . 0.0 111.554 176.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 1.039 HD13 ' HA ' ' A' ' 973' ' ' LEU . 8.6 mp -56.86 -64.37 2.59 Favored Pre-proline 0 N--CA 1.471 0.616 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.36 173.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.698 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 15.2 Cg_endo -57.67 -30.33 88.5 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.625 1.55 . . . . 0.0 111.826 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -58.17 -57.39 13.08 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.355 174.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 1.072 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 59.9 m -163.3 -47.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.118 0.485 . . . . 0.0 111.463 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.715 HG23 ' HB ' ' A' ' 984' ' ' ILE . 23.8 m -48.54 -24.12 1.21 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.539 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 49.8 p-80 -50.06 -32.51 15.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -66.71 -52.86 39.65 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 119.455 1.025 . . . . 0.0 111.968 176.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.763 ' HB3' HG11 ' A' 1038 ' ' VAL . 0.2 OUTLIER -70.71 -45.54 64.76 Favored 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.338 -179.23 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 1.033 HG22 ' HG ' ' A' ' 976' ' ' LEU . 8.8 tp -57.68 -39.38 69.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.609 -175.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 11.7 pt-20 -69.98 -27.28 64.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.014 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.584 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 5.4 ptp -71.97 -46.74 56.26 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.801 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.921 ' HB3' HG22 ' A' 1038 ' ' VAL . . . -72.48 -47.09 51.52 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.847 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.883 ' HA ' HD12 ' A' ' 991' ' ' LEU . 27.2 tt0 -57.59 -45.69 84.95 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -175.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -65.22 -35.08 79.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.441 0.639 . . . . 0.0 109.315 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.77 -35.6 78.99 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.682 177.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.883 HD12 ' HA ' ' A' ' 988' ' ' GLN . 15.6 mt -61.3 -57.47 12.2 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.316 0.579 . . . . 0.0 109.671 175.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -45.8 -43.0 12.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.053 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 17.1 p -76.26 -46.55 27.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.515 ' HB2' ' HB3' ' A' 1031 ' ' ASP . 1.0 OUTLIER -82.65 -37.32 25.05 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -169.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.656 ' HA ' HD11 ' A' 1028 ' ' LEU . 0.9 OUTLIER -58.61 -47.0 85.83 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 168.443 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.825 ' HA ' HG21 ' A' ' 999' ' ' ILE . . . -52.7 -28.38 21.66 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -77.13 -34.08 56.67 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 118.575 -1.25 . . . . 0.0 108.693 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.671 HD23 HD12 ' A' 1028 ' ' LEU . 18.6 tp -78.23 -29.03 48.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.953 ' HA ' HG12 ' A' ' 955' ' ' VAL . 5.8 tt -77.21 -0.74 3.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-O 121.908 0.861 . . . . 0.0 108.827 172.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.684 ' HA ' ' HB2' ' A' 1003 ' ' LYS . 6.8 m-80 -102.78 -6.36 22.67 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.62 170.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 1.014 ' HD3' ' HB2' ' A' 1021 ' ' MET . 42.3 tptt -73.12 -36.8 66.78 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 162.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.73 ' HB2' ' HB ' ' A' ' 955' ' ' VAL . 24.2 ttm -64.77 -60.96 2.49 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.42 -1.264 . . . . 0.0 108.626 171.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.777 ' O ' ' HB2' ' A' 1007 ' ' GLN . 45.3 mttp -65.17 -57.11 9.38 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.241 -174.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.663 HD23 ' HB3' ' A' 1017 ' ' TYR . 8.4 tt -82.3 -31.31 30.06 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -163.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.518 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -71.33 -43.19 67.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.075 178.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.431 HE21 ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -76.79 -26.28 54.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.458 176.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.777 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.9 tp-100 -53.83 -52.96 58.68 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.828 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.634 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 28.1 m-85 -92.18 -53.83 4.08 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.851 -175.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.507 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 11.3 p 40.63 45.51 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 122.16 0.981 . . . . 0.0 111.887 -176.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 17.9 mmt -88.77 90.61 8.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.517 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 44.4 p 40.91 -99.77 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 174.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 62.4 p -94.85 -28.18 15.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.892 0.377 . . . . 0.0 111.026 -176.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.58 -13.15 62.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.066 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.726 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 1.0 OUTLIER -57.91 -35.01 70.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.398 175.604 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.88 -22.41 62.31 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -53.99 -59.54 4.5 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 167.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.726 ' CD2' ' HA ' ' A' 1014 ' ' GLN . 0.3 OUTLIER -61.55 -20.43 63.25 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.713 ' O ' ' HB3' ' A' 1021 ' ' MET . 39.5 ttmt -79.35 -43.46 23.48 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.301 171.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.4 ' HE2' ' HB3' ' A' 1019 ' ' LYS . 5.8 tmmm? -68.04 -41.88 81.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.397 0.618 . . . . 0.0 109.343 177.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -56.23 -31.46 63.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.696 173.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1021 ' ' MET . . . . . 1.014 ' HB2' ' HD3' ' A' 1001 ' ' LYS . 43.5 ttp -56.49 -44.73 80.93 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 173.369 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.69 -43.05 76.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.595 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.1 m -71.38 -46.57 59.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.714 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.94 76.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.713 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -64.26 -36.35 83.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 110.491 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' 1030 ' ' VAL . 14.1 t-80 -66.94 -42.25 85.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.16 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.53 -47.54 85.09 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.477 0.485 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.693 ' HA ' ' OD2' ' A' 1031 ' ' ASP . 0.9 OUTLIER -65.41 -42.26 92.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.588 0.709 . . . . 0.0 110.233 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.61 -28.95 61.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.907 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' 1026 ' ' HIS . 74.2 t -74.29 -47.69 39.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.122 177.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.693 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -59.74 -42.36 92.99 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.694 179.193 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -62.83 -49.95 72.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.982 0.42 . . . . 0.0 110.436 175.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.727 ' HA ' HD23 ' A' 1036 ' ' LEU . 87.6 tttt -59.81 -38.51 82.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.706 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.526 ' O ' HG21 ' A' 1038 ' ' VAL . 9.1 t30 -72.4 -53.72 11.43 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.315 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.807 HD22 HD11 ' A' ' 991' ' ' LEU . 29.0 tp -56.5 -33.96 66.5 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.141 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.738 ' HA ' HG11 ' A' ' 929' ' ' VAL . 1.8 pp -61.79 -38.67 88.92 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.809 0.731 . . . . 0.0 109.396 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 12.0 t70 -66.97 -40.07 87.36 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.181 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.921 HG22 ' HB3' ' A' ' 987' ' ' ALA . 76.7 t -60.87 -68.44 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.653 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.98 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -70.07 -33.75 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -173.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.815 ' H ' HD11 ' A' 1039 ' ' ILE . 6.9 t70 -48.81 -45.18 40.04 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 122.43 1.109 . . . . 0.0 108.372 166.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.616 ' O ' ' HG2' ' A' 1045 ' ' LYS . 82.1 mm-40 -79.11 -24.84 43.13 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 113.487 -1.688 . . . . 0.0 111.134 177.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.658 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.01 -55.02 31.15 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.526 173.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 1.024 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 21.8 mmm180 -57.86 -32.97 68.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.829 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.619 HD13 ' HB ' ' A' 1047 ' ' ILE . 60.3 tp -77.99 -26.33 48.55 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 121.113 -0.235 . . . . 0.0 111.235 175.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 1.072 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 46.7 mmtm -57.08 -44.45 83.11 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.664 0.745 . . . . 0.0 109.536 171.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.716 ' HB2' HG11 ' A' ' 975' ' ' VAL . 26.9 ttt -65.62 -38.93 90.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.66 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.619 ' HB ' HD13 ' A' 1044 ' ' LEU . 49.7 mm -66.87 -35.81 75.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.894 175.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 36.9 t -60.55 -53.85 52.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.91 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -69.99 -44.2 69.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.046 0.451 . . . . 0.0 110.911 -178.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 46.2 m -94.36 22.87 5.61 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.388 -175.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.701 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 62.3 ttt180 -59.88 -50.73 85.14 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.535 176.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.701 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 11.4 Cg_exo -72.28 -75.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.601 1.534 . . . . 0.0 110.939 171.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 38.6 p-80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.562 177.687 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.915 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 20.3 tpt180 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.472 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 67.5 m 71.27 105.37 0.06 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -160.32 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.661 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -53.53 85.44 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -166.884 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 922' ' ' ASN . 1.9 t70 -47.16 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 112.785 -2.007 . . . . 0.0 113.238 -174.307 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.471 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.9 tmtp? -41.82 -23.15 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.428 -178.534 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.782 ' HA ' HG22 ' A' ' 968' ' ' THR . 1.9 m -56.41 -54.86 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 118.745 -0.645 . . . . 0.0 112.048 172.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.661 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 20.2 t80 -74.37 -34.91 63.5 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 118.843 -1.143 . . . . 0.0 107.934 -175.133 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 11.8 mm-40 -58.68 -57.27 13.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.113 -1.858 . . . . 0.0 112.877 -176.47 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.447 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 3.1 t-20 -73.72 -35.26 65.08 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.905 -171.554 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.754 HG23 ' CD2' ' A' ' 965' ' ' LEU . 3.8 t -61.69 -36.03 71.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.036 -0.666 . . . . 0.0 110.235 175.012 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.565 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 42.5 m -66.5 -37.75 85.74 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 171.942 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.36 -30.37 64.58 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.691 174.3 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.529 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 18.9 tp -61.42 -39.38 90.56 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 173.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.613 ' O ' HG13 ' A' ' 937' ' ' ILE . 48.0 t -66.14 -40.73 87.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.607 173.256 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.565 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.5 OUTLIER -61.73 -33.69 74.49 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 178.438 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.674 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -80.63 -26.56 37.65 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.33 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.569 ' O ' ' HG2' ' A' ' 939' ' ' MET . 9.5 p -78.19 -16.44 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 119.448 -0.901 . . . . 0.0 108.877 171.639 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 933' ' ' VAL . 51.4 mt -67.33 -38.13 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 167.112 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.674 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 64.9 mm-40 -52.52 -38.52 59.84 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.123 172.221 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.914 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.9 ptt? -61.63 -40.57 95.34 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 t -74.24 -31.05 62.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.378 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.651 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.1 t -71.57 -52.55 17.57 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.538 0.685 . . . . 0.0 110.095 -176.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.516 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -80.18 -11.03 59.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.03 -173.602 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.959 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -79.65 -26.97 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.748 0.785 . . . . 0.0 109.264 173.772 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.8 mt-30 -60.97 -51.77 76.98 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.83 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.651 ' HD3' ' O ' ' A' ' 941' ' ' SER . 85.5 Cg_endo -97.3 17.57 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.459 1.439 . . . . 0.0 114.992 -176.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -130.65 167.47 21.07 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.406 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 6.5 Cg_endo -90.52 170.02 3.81 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 124.031 3.154 . . . . 0.0 111.776 168.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.647 ' C ' ' H ' ' A' ' 950' ' ' GLU . 5.4 Cg_endo -47.06 -26.68 5.31 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 124.908 3.739 . . . . 0.0 115.023 -167.028 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 8.7 mm-40 -52.5 0.7 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.921 170.349 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.959 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -106.9 -25.17 11.77 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 109.74 -0.466 . . . . 0.0 109.74 179.31 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.482 ' HA ' ' HE3' ' A' ' 954' ' ' MET . 21.6 m-85 -47.02 -42.34 18.07 Favored 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 173.27 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.079 HG12 ' HD3' ' A' ' 953' ' ' PRO 0.25 0.4 OUTLIER -73.89 -58.29 2.17 Favored Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 119.028 -1.069 . . . . 0.0 113.024 178.52 . . . . . . . . 4 4 . 1 . 021 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.079 ' HD3' HG12 ' A' ' 952' ' ' VAL . 36.0 Cg_exo -64.4 -18.52 63.37 Favored 'Trans proline' 0 C--N 1.358 1.075 0 C-N-CA 121.92 1.747 . . . . 0.0 114.631 178.011 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.914 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 22.7 ptt? -70.8 -43.09 69.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 176.797 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.773 ' HB ' ' HB3' ' A' 1002 ' ' MET . 78.9 t -68.54 -27.64 37.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.664 172.329 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.686 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.4 tptm -52.32 -45.08 65.45 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 171.818 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 954' ' ' MET . 4.7 mm-40 -56.34 -46.77 79.78 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.988 177.648 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.526 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 9.8 p -81.93 -22.18 9.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -178.546 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.54 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -70.46 -45.34 54.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.842 -1.17 . . . . 0.0 112.016 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.413 HD23 ' HD3' ' A' ' 963' ' ' ARG . 87.5 mt -65.92 -24.35 66.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.686 0.279 . . . . 0.0 110.443 170.642 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.529 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -61.8 -55.41 30.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.665 175.865 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.894 HD12 ' HB2' ' A' ' 995' ' ' LEU . 6.7 tt -66.4 -27.45 67.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.501 -0.479 . . . . 0.0 110.656 179.609 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.413 ' HD3' HD23 ' A' ' 960' ' ' LEU . 17.1 mtp180 -65.69 -48.07 73.27 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.961 -0.462 . . . . 0.0 111.287 171.037 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 22.1 m -55.99 -40.52 73.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.739 0.781 . . . . 0.0 109.68 171.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.754 ' CD2' HG23 ' A' ' 929' ' ' VAL . 1.3 tm? -59.32 -28.69 67.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.482 175.151 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.28 -25.08 64.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.993 178.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 971' ' ' GLU . . . -68.74 -36.96 79.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.101 171.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.782 HG22 ' HA ' ' A' ' 925' ' ' VAL . 2.1 m -64.44 -40.8 96.43 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.379 172.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.554 HG11 HD11 ' A' ' 984' ' ' ILE . 85.4 t -55.35 -32.36 29.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.2 172.091 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.489 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.6 t70 -80.06 -29.53 39.22 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.806 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.642 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.6 mm-40 -64.13 -50.22 69.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.617 1.198 . . . . 0.0 108.828 170.527 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.59 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.0 t -64.55 -23.11 67.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.306 176.312 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.653 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 60.1 tp -57.02 -52.93 70.4 Favored Pre-proline 0 C--O 1.218 -0.558 0 CA-C-O 118.713 -0.661 . . . . 0.0 112.431 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.642 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.4 Cg_exo -58.14 -27.99 82.17 Favored 'Trans proline' 0 C--N 1.357 1.024 0 CA-C-N 121.202 1.465 . . . . 0.0 111.044 169.364 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.47 HG11 ' HB2' ' A' 1046 ' ' MET . 3.1 t -78.4 -8.56 11.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.508 176.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.978 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.6 tt -70.92 -52.79 9.4 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 118.942 -0.552 . . . . 0.0 111.077 177.347 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.543 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 32.6 Cg_endo -66.64 -18.57 53.87 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.291 1.327 . . . . 0.0 111.123 173.069 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.89 -55.72 8.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.567 171.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.6 m -171.34 -36.73 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.101 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.613 HG22 ' HB ' ' A' ' 984' ' ' ILE . 6.9 m -58.04 -17.18 16.03 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -171.008 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.978 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 5.3 p-80 -48.46 -19.59 0.34 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.811 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 -75.53 -55.19 5.91 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.874 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.991 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -79.41 -40.17 30.68 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.29 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.613 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.7 tp -54.62 -35.89 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.719 -172.764 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 9.0 pt-20 -76.33 -38.19 56.3 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.884 176.728 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.754 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 3.6 ptp -59.37 -50.74 72.79 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.832 -173.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.679 ' N ' ' HG3' ' A' ' 986' ' ' MET . . . -78.58 -37.4 42.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.461 -176.434 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.975 ' HA ' HD11 ' A' ' 991' ' ' LEU . 1.4 tm0? -61.86 -40.59 95.88 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.297 -177.255 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 38.6 mmtm -59.54 -40.69 88.03 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 173.663 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -68.27 -36.07 78.85 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.896 -179.168 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.975 HD11 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -59.97 -49.38 77.91 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.183 0.516 . . . . 0.0 110.33 178.583 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -54.4 -42.82 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.797 -178.184 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 63.0 m -74.69 -38.87 62.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.175 -176.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.526 ' OD2' ' HB3' ' A' 1027 ' ' ALA . 1.0 OUTLIER -89.33 -39.59 13.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -169.784 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.894 ' HB2' HD12 ' A' ' 962' ' ' LEU . 1.5 tm? -61.08 -31.43 71.1 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 168.744 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.68 -50.0 75.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.594 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.63 -32.36 71.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.807 174.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 1.013 HD22 ' HA ' ' A' 1025 ' ' ALA . 0.2 OUTLIER -65.77 -34.52 78.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.888 0.375 . . . . 0.0 110.463 175.668 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.463 HG21 ' HE2' ' A' 1002 ' ' MET . 78.0 mt -61.99 -35.7 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.585 0.707 . . . . 0.0 109.385 174.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.702 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.3 m-80 -85.46 -13.16 50.06 Favored 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.507 176.631 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.874 ' HG2' ' HB2' ' A' 1021 ' ' MET . 0.1 OUTLIER -68.76 -40.18 79.87 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.049 0.452 . . . . 0.0 110.251 175.963 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.994 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.8 ptt? -78.64 -34.17 46.66 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 81.4 tttt -73.48 -55.71 5.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.95 -177.416 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.626 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.1 mp -54.42 -45.16 72.92 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.7 84.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.176 0.512 . . . . 0.0 110.067 177.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.883 ' HG3' HG11 ' A' ' 952' ' ' VAL . 15.5 mm100 -78.69 -9.8 59.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.799 0.809 . . . . 0.0 112.09 178.52 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.587 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.3 tp-100 -77.91 -43.76 29.04 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.439 175.798 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.403 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 2.9 t80 -75.49 -57.56 3.81 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.311 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 9.9 p 40.09 35.93 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.871 1.268 . . . . 0.0 113.43 172.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.412 ' HG3' ' HB2' ' A' 1013 ' ' LEU . 46.2 tpp -86.11 120.79 27.86 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 175.276 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -51.04 117.55 2.62 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 20.5 m 77.49 -39.1 0.3 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.914 0.886 . . . . 0.0 111.974 178.408 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.412 ' HB2' ' HG3' ' A' 1010 ' ' MET . 8.9 mp -77.74 -8.0 57.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.158 0.504 . . . . 0.0 110.733 179.622 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.58 -25.81 40.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.68 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.45 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.9 pt20 -55.15 -33.89 63.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.196 -169.375 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -50.77 -51.12 53.43 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 111.279 173.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.403 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.1 m-30 -76.87 -21.61 54.7 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.512 178.309 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.886 ' HG3' ' HE2' ' A' 1021 ' ' MET . 38.6 ttpt -65.27 -39.82 93.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.425 177.65 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.94 -57.06 13.17 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.319 0.58 . . . . 0.0 109.885 176.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -48.85 -49.7 38.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.461 176.161 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.886 ' HE2' ' HG3' ' A' 1018 ' ' LYS . 0.0 OUTLIER -73.81 -19.0 60.88 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.435 -176.759 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.55 -48.09 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.2 m -63.93 -33.76 76.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.361 177.301 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -62.93 -33.6 75.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 178.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 1.013 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -69.69 -31.28 69.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 178.923 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.532 ' O ' HG21 ' A' 1030 ' ' VAL . 22.5 t-80 -64.88 -34.59 78.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.379 176.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.526 ' HB3' ' OD2' ' A' ' 994' ' ' ASP . . . -57.57 -46.94 83.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.054 175.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.835 HD12 ' HG ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -62.49 -46.27 89.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.88 0.847 . . . . 0.0 110.554 177.39 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.81 -36.98 68.05 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.732 -179.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.532 HG21 ' O ' ' A' 1026 ' ' HIS . 88.6 t -65.9 -35.7 75.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 173.283 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.669 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.72 -39.21 73.52 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.108 -178.478 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.71 -53.43 56.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.073 171.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.585 ' O ' ' HG ' ' A' 1036 ' ' LEU . 2.9 tmtp? -60.32 -48.21 82.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.048 -174.195 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.606 ' O ' HG21 ' A' 1038 ' ' VAL . 8.9 t30 -64.86 -36.53 84.64 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.823 -176.016 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.874 HD21 HD13 ' A' ' 991' ' ' LEU . 15.4 tp -78.98 -33.18 45.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 119.694 -0.193 . . . . 0.0 110.516 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.868 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.2 pp -67.64 -18.35 64.93 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 120.961 0.41 . . . . 0.0 109.899 -178.967 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -88.73 -38.91 14.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.222 169.771 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.991 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -50.68 -61.56 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.938 173.136 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.868 HD11 ' HA ' ' A' 1036 ' ' LEU . 1.7 pp -78.58 -24.22 13.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.125 -178.136 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.748 ' H ' HD12 ' A' 1039 ' ' ILE . 13.8 t0 -59.56 -36.18 75.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 164.809 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.588 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.8 mm-40 -72.57 -36.58 68.23 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.678 170.695 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.699 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -51.66 -53.22 41.2 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 123.223 0.327 . . . . 0.0 111.241 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.915 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 7.7 ppt_? -52.42 -38.99 60.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.699 176.009 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.647 ' N ' ' HD2' ' A' 1043 ' ' ARG . 48.2 tp -80.47 -23.42 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 121.001 -0.279 . . . . 0.0 111.29 177.487 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.732 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 28.5 mmmt -62.95 -42.68 99.89 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.668 0.747 . . . . 0.0 109.062 176.077 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.47 ' HB2' HG11 ' A' ' 975' ' ' VAL . 1.6 tmt? -61.84 -39.19 90.98 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.191 175.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.505 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 37.4 mm -61.05 -36.6 73.59 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.255 173.618 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.0 t -62.4 -21.9 65.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.869 0.366 . . . . 0.0 111.04 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -85.77 -38.62 18.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.071 178.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 23.5 t -83.19 -26.98 30.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 0.0 110.345 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -121.53 89.01 46.99 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.165 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.494 ' HG2' ' HD2' ' A' 1053 ' ' HIS . 72.6 Cg_endo -81.43 -23.39 5.06 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.538 2.159 . . . . 0.0 112.654 -179.258 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.494 ' HD2' ' HG2' ' A' 1052 ' ' PRO . 13.3 p80 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.404 -0.807 . . . . 0.0 109.909 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.729 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 20.5 tpt180 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 18.3 m 70.88 5.57 5.51 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 123.073 0.549 . . . . 0.0 110.646 -177.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.505 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.5 OUTLIER 55.67 78.15 0.2 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.317 171.981 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.512 ' CG ' ' HG3' ' A' 1043 ' ' ARG . 2.4 p30 -55.03 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 112.356 -2.202 . . . . 0.0 112.257 -176.006 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.547 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 3.4 tmtp? -25.38 -25.24 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.238 1.415 . . . . 0.0 114.384 177.092 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.843 HG21 ' HG2' ' A' 1043 ' ' ARG . 13.4 m -62.79 -52.79 55.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 174.263 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 60.9 t80 -77.59 -31.17 52.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.163 0.982 . . . . 0.0 108.586 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.493 ' O ' ' HB ' ' A' ' 930' ' ' THR . 39.8 mt-10 -68.0 -49.77 59.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.931 -179.407 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.547 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 41.3 t30 -73.96 -30.33 62.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.669 HG22 HD13 ' A' ' 965' ' ' LEU . 45.2 t -64.75 -42.39 94.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.811 173.25 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.708 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.7 m -50.57 -29.4 10.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.204 0.526 . . . . 0.0 110.007 165.397 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . 0.405 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -70.77 -27.97 71.52 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.822 178.125 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.729 ' HA ' ' HB3' ' A' ' 961' ' ' ALA . 6.2 tt -64.61 -45.58 86.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.033 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 937' ' ' ILE . 35.2 t -57.04 -45.69 84.05 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.726 173.214 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.708 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.9 mmpt? -56.21 -45.5 79.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.701 178.117 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.715 ' HB2' ' HB1' ' A' ' 961' ' ' ALA . . . -77.48 -26.08 51.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.866 -177.41 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.4 p -80.44 -15.76 12.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.466 172.895 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.667 HG12 ' O ' ' A' ' 933' ' ' VAL . 25.0 mm -69.19 -28.06 37.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.479 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.51 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 11.1 mm-40 -62.49 -47.05 85.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.256 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.51 ' HE1' ' HE1' ' A' ' 954' ' ' MET . 24.1 ttt -57.05 -38.44 73.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.704 174.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.61 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 19.5 m -67.29 -40.73 86.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.127 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.5 t -76.43 -42.78 42.89 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -177.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 7.6 mmtm -48.45 -56.18 8.94 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 113.534 -1.666 . . . . 0.0 111.293 175.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.671 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.4 tt -66.61 -25.26 34.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 123.651 0.594 . . . . 0.0 112.006 -173.518 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.753 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 81.4 mm-40 -51.92 -59.54 8.01 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 119.44 -0.314 . . . . 0.0 111.777 -179.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.753 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.0 Cg_endo -100.64 14.9 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.631 1.554 . . . . 0.0 113.555 174.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -75.75 137.59 70.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -174.341 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 950' ' ' GLU . 93.3 Cg_endo -85.63 178.74 4.22 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 123.141 2.561 . . . . 0.0 109.47 160.05 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.609 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 8.5 Cg_endo -51.45 -36.66 59.64 Favored 'Trans proline' 0 C--O 1.247 0.97 0 C-N-CA 122.479 2.119 . . . . 0.0 111.943 176.572 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -59.44 -16.16 21.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.582 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.561 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -114.36 -9.49 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.558 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.709 ' O ' ' HG2' ' A' ' 954' ' ' MET . 24.4 m-85 -58.65 -41.83 86.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.584 0.706 . . . . 0.0 109.523 172.702 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -73.68 -52.04 5.01 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.374 177.236 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.2 Cg_exo -56.04 -27.46 64.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.963 1.775 . . . . 0.0 115.152 173.262 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.709 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 24.8 ptt? -68.5 -42.98 77.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.676 0.751 . . . . 0.0 109.601 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.755 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.3 t -71.32 -24.73 24.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.581 174.739 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 48.0 tttm -56.47 -43.56 79.69 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 173.469 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.425 ' HB3' ' HB2' ' A' ' 938' ' ' GLU . 4.5 mm-40 -54.05 -47.87 71.17 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.106 173.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.575 HG12 ' O ' ' A' ' 955' ' ' VAL . 4.5 p -69.94 -21.12 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.116 177.936 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.568 ' HA2' HD22 ' A' ' 995' ' ' LEU . . . -63.59 -41.43 99.13 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 170.575 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 41.6 tp -73.74 -10.18 59.42 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.248 0.547 . . . . 0.0 110.275 175.333 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.729 ' HB3' ' HA ' ' A' ' 932' ' ' LEU . . . -76.14 -56.4 4.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.468 -177.774 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.467 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 59.7 tp -76.02 -17.15 59.8 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.844 0.355 . . . . 0.0 110.43 175.399 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.729 ' HE ' ' HA ' ' A' ' 963' ' ' ARG . 0.3 OUTLIER -64.71 -65.76 0.63 Allowed 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.472 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.1 m -58.52 -22.09 54.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.353 175.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.669 HD13 HG22 ' A' ' 929' ' ' VAL . 19.8 tp -75.4 -36.81 60.8 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.5 -33.99 56.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.829 172.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -58.46 -49.84 75.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.179 173.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.759 HG22 ' HA ' ' A' ' 925' ' ' VAL . 9.4 m -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.961 171.684 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.9 t -54.79 -32.02 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 122.384 -0.198 . . . . 0.0 110.715 174.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.473 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 10.6 t70 -69.17 -32.31 71.54 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.309 176.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.587 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 60.1 mm-40 -60.59 -57.86 10.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 122.294 1.045 . . . . 0.0 109.111 172.651 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.496 ' OG ' HG23 ' A' ' 980' ' ' THR . 41.3 t -66.52 -22.69 66.17 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.341 -1.3 . . . . 0.0 112.264 -178.003 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.763 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.1 tp -61.67 -48.61 89.44 Favored Pre-proline 0 C--O 1.217 -0.644 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.082 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.714 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 31.5 Cg_exo -63.54 -26.87 69.71 Favored 'Trans proline' 0 C--N 1.356 0.933 0 CA-C-N 121.58 1.6 . . . . 0.0 110.683 167.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.683 HG12 ' HE2' ' A' 1045 ' ' LYS . 19.4 t -74.34 -12.63 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.545 176.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.763 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 0.7 OUTLIER -72.16 -54.0 6.06 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.128 177.778 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.744 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 24.4 Cg_exo -63.51 -22.61 70.93 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.392 1.395 . . . . 0.0 110.643 178.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -61.25 2.33 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.027 171.759 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 1.008 ' HB2' ' HD3' ' A' 1045 ' ' LYS . 29.0 m -161.07 -42.62 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.813 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.681 HG21 ' HB ' ' A' ' 984' ' ' ILE . 18.3 m -45.97 -21.1 0.11 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.14 1.534 . . . . 0.0 115.14 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.696 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 78.7 t60 -47.63 -36.48 10.96 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.726 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.574 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 4.9 ptp180 -61.52 -56.07 24.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.739 176.747 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.752 ' HG3' HG21 ' A' 1038 ' ' VAL . 0.6 OUTLIER -76.79 -49.33 16.13 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.141 -0.623 . . . . 0.0 112.025 -174.793 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.681 ' HB ' HG21 ' A' ' 980' ' ' THR . 11.2 tt -50.58 -42.29 21.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.376 -174.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -68.1 -30.17 69.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.982 -177.16 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.667 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.5 ptm -62.51 -57.1 12.39 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.121 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.92 -34.94 38.53 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -176.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.748 ' HA ' HD11 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -55.48 -52.68 62.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.951 0.405 . . . . 0.0 110.44 -177.407 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.427 ' HZ3' ' HB2' ' A' ' 989' ' ' LYS . 10.2 mtmp? -73.16 -23.91 60.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.64 . . . . 0.0 109.854 -179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.61 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 18.6 tp -65.9 -51.66 56.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.718 175.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' A' ' 988' ' ' GLN . 9.4 mt -53.08 -52.1 59.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.644 175.264 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -48.09 -43.05 30.36 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.358 178.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 50.4 m -65.02 -50.54 65.86 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.901 -178.001 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.622 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.3 m-20 -94.86 -25.41 16.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -169.271 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.568 HD22 ' HA2' ' A' ' 959' ' ' GLY . 2.9 tm? -52.84 -55.5 22.61 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.859 0.754 . . . . 0.0 109.265 165.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -52.71 -41.16 63.68 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.639 173.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.825 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.5 mm-40 -58.04 -48.58 79.66 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 123.779 0.674 . . . . 0.0 109.782 178.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.774 HD22 ' HA ' ' A' 1025 ' ' ALA . 31.2 tp -72.32 -32.79 66.84 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.567 0.542 . . . . 0.0 110.252 -172.426 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.788 ' O ' ' HG2' ' A' 1002 ' ' MET . 37.6 mm -63.5 -56.29 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 122.678 1.227 . . . . 0.0 107.931 173.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.707 ' O ' ' HB2' ' A' 1004 ' ' LEU . 43.0 t30 -58.22 -13.5 5.18 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 113.825 -1.534 . . . . 0.0 112.458 172.047 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.825 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 71.5 mmtt -87.24 -40.42 14.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.223 0.919 . . . . 0.0 111.081 172.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.836 ' HE2' HG23 ' A' ' 952' ' ' VAL . 12.0 ptt? -61.89 -34.67 76.45 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.729 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.6 ttmt -70.91 -57.98 4.05 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 113.844 -1.525 . . . . 0.0 108.556 172.62 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.707 ' HB2' ' O ' ' A' 1000 ' ' ASN . 2.9 tt -48.33 -57.88 5.38 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.714 0.634 . . . . 0.0 111.589 -173.659 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.1 -48.37 81.99 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.078 0.466 . . . . 0.0 110.562 -175.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.556 ' HA ' HG23 ' A' 1009 ' ' VAL . 29.2 mm-40 -79.11 -15.32 58.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.112 -176.451 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.729 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.0 tp-100 -87.09 -37.94 16.94 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.417 177.851 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.496 ' HD2' ' CG ' ' A' 1017 ' ' TYR . 19.7 t80 -83.31 -8.67 59.39 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.854 -176.428 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.556 HG23 ' HA ' ' A' 1006 ' ' GLN . 54.0 t -36.32 109.46 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 O-C-N 124.21 0.944 . . . . 0.0 112.89 179.357 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.487 ' HG2' HG23 ' A' 1011 ' ' THR . 24.4 ttt -100.83 -75.34 0.59 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.169 172.789 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.487 HG23 ' HG2' ' A' 1010 ' ' MET . 8.9 t 178.13 125.61 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.653 174.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.7 m 70.51 -49.96 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.503 0.721 . . . . 0.0 111.758 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' 1016 ' ' GLU . 95.6 mt -65.99 -4.95 8.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.432 0.693 . . . . 0.0 111.843 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.516 ' HG2' HG22 ' A' 1009 ' ' VAL . 0.5 OUTLIER -52.04 -43.42 63.74 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -177.494 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.574 ' OE1' ' HD3' ' A' 1018 ' ' LYS . 6.0 tp-100 -51.37 -35.38 38.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.584 -177.077 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.523 ' HA ' ' HE3' ' A' 1019 ' ' LYS . 2.6 tp10 -56.54 -59.62 4.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.338 0.589 . . . . 0.0 111.483 171.589 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' 1017 ' ' TYR . 0.1 OUTLIER -50.06 -39.39 41.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.711 177.466 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.574 ' HD3' ' OE1' ' A' 1015 ' ' GLN . 86.4 tttt -60.98 -31.58 71.17 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.693 -1.14 . . . . 0.0 113.136 177.244 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.523 ' HE3' ' HA ' ' A' 1016 ' ' GLU . 89.8 mttt -58.5 -48.98 79.01 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.639 0.733 . . . . 0.0 109.23 177.028 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -51.96 -43.05 63.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.378 177.806 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.7 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 14.1 tmm? -65.12 -48.24 74.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.798 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.81 -32.85 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 -175.379 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 30.2 m -68.88 -47.06 66.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.081 0.467 . . . . 0.0 110.202 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.7 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -64.51 -35.62 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.271 177.888 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.774 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -60.87 -42.1 97.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.131 0.491 . . . . 0.0 110.446 176.132 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.562 ' O ' HG23 ' A' 1030 ' ' VAL . 58.1 t60 -69.14 -33.16 73.01 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.138 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.37 -46.92 84.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.119 176.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.538 HD11 ' N ' ' A' ' 995' ' ' LEU . 17.9 tp -59.72 -47.2 86.59 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.268 0.556 . . . . 0.0 110.27 177.206 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -54.69 -32.33 59.28 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.258 174.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' 1026 ' ' HIS . 89.9 t -72.46 -40.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 122.076 -0.39 . . . . 0.0 110.546 172.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.622 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 28.0 m-20 -57.7 -47.16 83.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.697 173.854 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' 1036 ' ' LEU . . . -52.74 -39.45 62.16 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.292 169.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' 1036 ' ' LEU . 35.2 tttm -71.93 -35.08 69.53 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.375 -176.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.585 ' O ' HG22 ' A' 1038 ' ' VAL . 66.2 t30 -70.8 -54.51 11.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 -178.831 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.843 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 15.2 tp -64.02 -28.35 69.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' 1040 ' ' ASP . 55.1 tp -51.37 -44.35 62.08 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.685 174.03 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.581 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 19.4 t70 -91.45 -26.92 18.61 Favored 'General case' 0 C--O 1.22 -0.461 0 O-C-N 124.105 0.878 . . . . 0.0 110.692 -179.345 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.843 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 25.2 t -57.42 -57.46 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 123.12 0.568 . . . . 0.0 111.967 177.04 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.743 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 7.9 pt -86.92 -27.37 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.947 -178.11 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.581 ' HB3' ' HA ' ' A' 1037 ' ' ASP . 2.4 t70 -44.21 -48.38 9.32 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 157.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.663 ' HA ' ' HB3' ' A' 1044 ' ' LEU . 23.4 tt0 -78.23 -23.84 47.24 Favored 'General case' 0 C--O 1.192 -1.936 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.494 176.428 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.84 ' O ' ' HG3' ' A' 1045 ' ' LYS . . . -56.29 -47.36 78.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.619 0.723 . . . . 0.0 111.504 175.632 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.843 ' HG2' HG21 ' A' ' 925' ' ' VAL . 5.9 mmm180 -79.46 -23.68 42.91 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.469 -0.769 . . . . 0.0 110.917 177.11 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.663 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.0 tp -78.38 -29.2 47.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.096 0.474 . . . . 0.0 110.498 175.474 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 1.008 ' HD3' ' HB2' ' A' ' 979' ' ' SER . 0.1 OUTLIER -71.42 -25.7 62.44 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 176.518 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 59.7 ttp -73.89 -28.69 61.68 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.603 175.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.463 ' HB ' ' O ' ' A' 1044 ' ' LEU . 45.0 mm -69.89 -32.8 53.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 168.232 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.739 ' HB2' ' O ' ' A' 1045 ' ' LYS . 44.0 m -57.56 -23.75 52.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.245 172.541 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -69.57 -53.63 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.128 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' 1051 ' ' ARG . 6.3 m -63.37 -59.69 4.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.677 179.257 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.892 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 46.2 mtp180 88.34 -88.09 0.0 OUTLIER Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.303 1.441 . . . . 0.0 112.999 179.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.892 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 2.8 Cg_endo -79.81 97.95 1.11 Allowed 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 121.656 1.627 . . . . 0.0 112.438 -173.579 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 17.2 t60 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.408 177.075 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.773 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 21.1 tpt180 . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.421 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 47.9 m -61.22 126.55 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 164.365 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.1 OUTLIER -64.29 84.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.529 0.681 . . . . 0.0 112.475 -170.599 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.732 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.1 t70 -47.04 -174.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.75 -174.902 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.45 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.9 tmtm? -36.03 -27.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.146 0.978 . . . . 0.0 111.96 -179.869 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.841 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 3.3 m -55.32 -53.64 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-O 119.16 -0.448 . . . . 0.0 112.049 175.19 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.495 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 23.5 t80 -75.74 -33.92 60.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.634 -174.091 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -46.36 75.53 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.585 -173.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.5 ' ND2' ' HA ' ' A' ' 965' ' ' LEU . 4.1 t30 -73.97 -38.99 64.01 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.677 -174.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.596 HG22 ' CD2' ' A' ' 965' ' ' LEU . 12.0 t -65.24 -33.62 64.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.403 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.478 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 3.9 p -72.73 -27.44 62.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 171.095 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . 0.426 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -60.78 -30.61 73.15 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.342 167.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.79 ' HA ' ' HB2' ' A' ' 961' ' ' ALA . 3.7 tt -62.86 -38.2 89.89 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 174.901 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.532 ' O ' HG13 ' A' ' 937' ' ' ILE . 70.3 t -65.27 -41.37 91.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.495 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.578 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.2 mmpt? -60.72 -33.69 73.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.013 0.435 . . . . 0.0 110.284 177.458 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.694 ' HB1' ' HB3' ' A' ' 961' ' ' ALA . . . -78.97 -26.21 43.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.562 -178.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.539 ' HA ' HG13 ' A' ' 958' ' ' VAL . 12.9 p -82.87 -12.05 12.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.792 0.806 . . . . 0.0 109.334 171.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 59.2 mt -70.55 -41.26 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.092 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.648 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 56.5 mm-40 -53.74 -43.09 68.85 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.038 169.747 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.574 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 24.7 ttt -58.29 -41.15 83.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.562 177.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.69 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 40.6 m -67.83 -41.23 83.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.923 -179.764 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.486 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 11.8 p -76.39 -40.62 50.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -175.104 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 954' ' ' MET . 7.8 mmtp -53.63 -49.58 67.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.126 178.829 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.834 ' HB ' ' HE1' ' A' ' 954' ' ' MET . 17.5 tt -71.28 -27.75 30.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.785 -173.437 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.807 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 91.9 mt-30 -56.42 -63.21 3.66 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.42 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.807 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.6 Cg_endo -97.34 -12.12 0.49 Allowed 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.451 1.434 . . . . 0.0 114.378 -175.333 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.446 ' HB3' ' HB2' ' A' ' 950' ' ' GLU . . . -95.86 152.28 38.92 Favored Pre-proline 0 C--N 1.323 -0.573 0 O-C-N 122.073 -0.392 . . . . 0.0 112.007 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 2.8 Cg_exo -76.89 178.7 7.29 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.584 2.856 . . . . 0.0 112.432 -178.212 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.717 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 50.0 Cg_exo -55.88 -27.32 62.37 Favored 'Trans proline' 0 C--O 1.245 0.852 0 C-N-CA 122.821 2.347 . . . . 0.0 112.561 176.233 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -55.73 -27.45 50.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.047 173.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.447 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -102.03 -5.1 24.97 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.342 175.782 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.766 ' HA ' ' HE2' ' A' ' 954' ' ' MET . 6.8 m-30 -56.45 -43.71 79.76 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.515 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.07 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -74.68 -51.8 3.87 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 119.97 -0.692 . . . . 0.0 112.159 176.689 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.993 ' HD3' HG12 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.86 -32.89 48.8 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.167 1.911 . . . . 0.0 113.972 173.632 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.834 ' HE1' ' HB ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -60.02 -54.91 40.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.878 0.847 . . . . 0.0 110.633 178.553 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.823 ' HB ' ' HB3' ' A' 1002 ' ' MET . 94.2 t -63.22 -26.5 41.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.151 172.539 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 19.2 tptm -65.01 -27.26 68.7 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.046 177.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -59.33 -46.51 88.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.308 172.057 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.838 HG23 HD22 ' A' ' 998' ' ' LEU . 2.5 m -72.29 -24.08 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.24 175.869 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.506 ' HA2' HD23 ' A' ' 995' ' ' LEU . . . -71.02 -43.51 57.16 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.265 -0.969 . . . . 0.0 111.141 176.521 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.88 -33.16 68.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.246 170.263 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.79 ' HB2' ' HA ' ' A' ' 932' ' ' LEU . . . -58.86 -56.48 21.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.32 179.841 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.685 HD13 ' HB3' ' A' ' 991' ' ' LEU . 6.9 tt -71.43 -31.62 67.43 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.506 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.07 -55.51 34.04 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.815 -0.553 . . . . 0.0 111.148 171.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 m -58.78 -33.02 69.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.525 0.679 . . . . 0.0 110.339 174.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.63 HD21 HD21 ' A' 1035 ' ' LEU . 1.8 tm? -63.53 -34.12 77.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.291 174.512 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 35.6 tp -62.46 -25.81 68.18 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.348 178.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.96 -43.05 84.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.175 0.512 . . . . 0.0 110.085 171.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.665 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 6.9 m -61.89 -37.44 84.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.294 173.82 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 965' ' ' LEU . 97.5 t -58.14 -31.25 41.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.115 174.457 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.47 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 22.0 t70 -76.79 -23.61 52.88 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.067 0.46 . . . . 0.0 110.824 178.405 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.531 ' O ' HG21 ' A' ' 975' ' ' VAL . 63.8 mm-40 -70.52 -53.71 15.07 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.379 1.085 . . . . 0.0 108.839 169.7 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.704 ' OG ' HG23 ' A' ' 980' ' ' THR . 40.8 t -66.95 -25.95 66.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.149 -178.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.692 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 57.3 tp -62.59 -53.21 59.15 Favored Pre-proline 0 C--O 1.218 -0.595 0 CA-C-O 118.863 -0.589 . . . . 0.0 112.297 -176.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.1 Cg_exo -54.86 -32.22 76.48 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 120.928 1.367 . . . . 0.0 111.297 169.193 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.561 HG13 ' HG1' ' A' ' 980' ' ' THR . 2.8 t -77.46 -10.47 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.591 177.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.733 ' HG ' ' CB ' ' A' ' 981' ' ' HIS . 2.3 tt -65.59 -53.2 38.84 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.182 176.761 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.62 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 37.6 Cg_exo -61.87 -33.55 84.17 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.353 1.369 . . . . 0.0 110.842 173.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.96 27.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.918 175.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 8.7 m -170.73 -26.95 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -177.601 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.751 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 37.2 m -63.2 -20.92 65.86 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 -170.613 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.733 ' CB ' ' HG ' ' A' ' 976' ' ' LEU . 1.8 p80 -50.79 -21.91 1.89 Allowed 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -171.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -69.2 -54.5 14.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 119.883 -0.727 . . . . 0.0 110.535 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 1.006 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.99 -43.07 30.66 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.662 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.605 ' HB ' HG21 ' A' ' 980' ' ' THR . 10.6 tp -60.23 -29.14 43.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.512 -175.031 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.37 -36.67 63.57 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.426 172.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.546 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 20.6 ptm -68.92 -52.73 26.3 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.991 -175.767 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.733 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.19 -46.22 21.05 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.487 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 1.018 ' HA ' HD12 ' A' ' 991' ' ' LEU . 23.2 tp60 -60.64 -37.56 81.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.291 -175.126 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -59.6 -41.94 91.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.737 0.78 . . . . 0.0 109.173 174.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' A' ' 987' ' ' ALA . 0.1 OUTLIER -72.77 -35.68 67.5 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.973 179.417 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 1.018 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.0 mt -60.72 -50.13 74.71 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.626 0.727 . . . . 0.0 109.837 179.164 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.429 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 26.6 t-20 -56.67 -41.87 78.01 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.235 -175.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.484 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 11.5 p -75.54 -33.2 60.66 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -178.248 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.09 -41.87 10.26 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -171.327 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.79 ' HA ' HD13 ' A' 1028 ' ' LEU . 0.6 OUTLIER -59.56 -39.11 82.95 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 171.141 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.429 ' HB1' ' O ' ' A' ' 992' ' ' ASN . . . -54.86 -48.93 72.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.771 178.251 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 993' ' ' SER . 62.6 mm-40 -57.61 -38.93 75.76 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.373 179.434 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.838 HD22 HG23 ' A' ' 958' ' ' VAL . 14.9 tp -70.39 -29.8 66.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.089 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.737 HG23 ' HE3' ' A' 1002 ' ' MET . 44.4 mt -61.82 -35.75 69.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.893 173.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.65 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 41.9 m-80 -88.42 -5.5 58.23 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.101 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 5.2 mptp? -86.19 -34.64 20.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 174.687 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.07 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.9 ptt? -73.47 -35.95 65.77 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 171.978 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.771 ' O ' ' HB2' ' A' 1007 ' ' GLN . 87.3 tttt -62.27 -56.89 14.1 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.213 174.663 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.64 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.0 mp -64.97 -35.79 82.33 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 178.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -63.31 -47.36 82.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.899 0.857 . . . . 0.0 109.851 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -8.4 56.88 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.196 177.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.771 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.0 tp-100 -90.42 -21.18 22.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.397 178.561 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 77.9 t80 -116.26 3.76 13.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.807 -174.876 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.464 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 6.4 p -49.91 102.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.911 -178.213 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 52.4 ttp -148.5 112.75 5.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.144 177.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 56.0 p 46.28 -104.55 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.346 173.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 6.3 t -124.35 -0.88 8.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.346 0.593 . . . . 0.0 109.773 -176.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 22.8 tp -83.66 -9.37 58.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.978 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.464 ' CG ' ' HA ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -61.0 -21.86 63.98 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.48 -179.896 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.563 ' O ' ' HG2' ' A' 1019 ' ' LYS . 27.3 pt20 -55.32 -33.9 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.561 -176.412 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.6 tt0 -50.19 -49.17 53.39 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 170.893 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1017 ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -80.04 -14.6 58.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 179.228 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.466 ' HB3' ' O ' ' A' 1015 ' ' GLN . 56.8 tttp -68.63 -36.19 78.28 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 171.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' 1015 ' ' GLN . 32.5 mmtp -68.67 -55.26 12.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.457 176.396 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' 1016 ' ' GLU . 49.5 mm-40 -48.37 -38.42 19.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.849 173.11 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.458 ' HB3' ' O ' ' A' 1018 ' ' LYS . 37.8 ttm -58.79 -57.47 12.86 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 176.346 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.49 -34.97 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -179.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 61.8 m -60.71 -40.17 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.873 177.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.42 ' HB1' ' HE3' ' A' 1001 ' ' LYS . . . -78.69 -31.28 46.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.507 179.201 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.545 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -65.15 -41.12 95.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.2 176.348 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.636 ' O ' HG22 ' A' 1030 ' ' VAL . 12.8 t-80 -63.84 -40.0 95.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.949 174.177 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.87 -45.94 80.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.07 -179.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.79 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.1 -28.77 64.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.504 0.668 . . . . 0.0 110.232 178.204 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.474 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.63 -41.43 85.94 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.682 -0.636 . . . . 0.0 109.694 171.483 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' 1026 ' ' HIS . 48.1 t -59.95 -30.75 46.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.468 174.167 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.452 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -76.5 -40.93 48.76 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 109.804 178.723 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.45 -52.64 64.77 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 121.252 0.549 . . . . 0.0 110.718 175.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.579 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 19.7 pttp -65.89 -32.18 73.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -172.055 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.522 ' O ' HG23 ' A' 1038 ' ' VAL . 64.9 t30 -73.6 -35.69 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.139 179.551 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.792 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -76.33 -32.5 58.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 -178.154 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.855 ' HA ' HD12 ' A' 1039 ' ' ILE . 4.4 pp -66.54 -23.61 66.25 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.27 -39.53 25.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.566 169.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 1.006 HG12 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -53.58 -65.41 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.117 -0.947 . . . . 0.0 112.792 175.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.855 HD12 ' HA ' ' A' 1036 ' ' LEU . 1.5 pp -74.86 -27.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.348 -177.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.799 ' H ' HD13 ' A' 1039 ' ' ILE . 11.7 t70 -50.35 -45.56 55.18 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.268 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.734 ' O ' ' HG2' ' A' 1045 ' ' LYS . 47.6 mt-30 -76.75 -28.69 55.84 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.031 176.017 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.686 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.84 -55.98 19.15 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.973 0.806 . . . . 0.0 111.729 176.536 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.773 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 1.4 mpt_? -58.49 -31.37 67.8 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.924 174.433 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.1 tp -76.38 -20.91 56.7 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.848 175.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.2 mmtt -67.41 -32.66 73.71 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.151 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 15.5 tmm? -69.12 -37.43 78.34 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.795 176.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.484 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 49.2 mm -65.47 -37.77 80.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.919 172.82 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.436 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.3 m -58.07 -42.62 85.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.721 177.492 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -75.43 -44.39 44.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.852 178.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 12.1 m -100.16 31.15 3.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.476 -174.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -53.65 139.66 49.67 Favored Pre-proline 0 C--O 1.235 0.323 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.212 -179.35 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.93 119.75 7.2 Favored 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 123.211 2.607 . . . . 0.0 113.256 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 42.6 m80 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.57 -0.729 . . . . 0.0 109.698 176.118 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.411 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 15.0 tpt180 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 28.1 t -85.04 84.37 7.74 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.616 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.512 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -11.61 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.065 1.746 . . . . 0.0 114.114 -175.459 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.859 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 2.2 t0 -47.22 -173.4 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 112.552 -2.113 . . . . 0.0 113.275 -174.238 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.472 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.4 tmtp? -37.25 -24.7 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.922 -1.035 . . . . 0.0 112.209 177.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.809 HG11 HG23 ' A' ' 968' ' ' THR . 5.3 m -56.45 -52.15 56.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 122.615 0.366 . . . . 0.0 111.899 172.955 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.55 ' HD1' ' CD2' ' A' 1036 ' ' LEU . 4.8 t80 -68.88 -29.58 67.9 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -178.173 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 6.3 mm-40 -68.39 -65.55 0.68 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.092 -1.413 . . . . 0.0 113.374 -173.881 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.687 HD22 ' HB ' ' A' ' 968' ' ' THR . 22.0 p-10 -73.24 -30.73 63.67 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.503 -172.556 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.645 HG21 ' CD1' ' A' ' 965' ' ' LEU . 45.9 t -64.02 -37.15 79.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.335 177.204 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.549 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 12.2 p -73.28 -28.02 61.88 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 171.275 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . 0.519 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -58.52 -28.27 62.15 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 114.699 -1.137 . . . . 0.0 112.546 169.18 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 965' ' ' LEU . 3.7 tt -66.02 -44.58 84.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.943 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.542 ' O ' HG12 ' A' ' 937' ' ' ILE . 66.1 t -57.81 -38.06 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.588 172.193 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 930' ' ' THR . 9.8 mmpt? -62.96 -36.12 82.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 175.738 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.666 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.94 -25.81 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.642 -179.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.551 ' HA ' HG11 ' A' ' 958' ' ' VAL . 14.5 p -81.6 -16.41 12.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.558 172.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 933' ' ' VAL . 47.6 mm -69.26 -37.48 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 165.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.2 mm-40 -53.87 -37.38 63.63 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.704 171.367 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.648 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 59.6 ttp -58.87 -45.65 89.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.579 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 31.8 m -71.87 -28.62 63.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 178.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.586 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.0 m -77.36 -41.17 41.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.138 0.971 . . . . 0.0 108.391 -176.48 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.516 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.8 mmtp -59.22 -42.07 90.13 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 113.532 -1.667 . . . . 0.0 111.955 179.318 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.447 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.6 tt -71.66 -24.55 23.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.065 -176.168 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.769 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 76.4 mt-30 -55.82 -62.68 4.2 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.769 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -100.49 12.25 0.52 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.749 1.633 . . . . 0.0 114.26 -176.103 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.477 ' HB2' ' HB2' ' A' ' 950' ' ' GLU . . . -131.47 155.24 81.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.712 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.3 Cg_endo -93.21 -169.37 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 123.886 3.058 . . . . 0.0 112.701 -177.304 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.712 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 94.7 Cg_exo -49.51 -32.8 28.4 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.282 2.655 . . . . 0.0 113.559 176.464 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.532 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 73.4 mm-40 -53.63 -20.9 5.83 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.917 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.507 ' C ' ' HD2' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -118.73 -6.86 10.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.565 -178.591 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 1.024 ' HA ' ' HE1' ' A' ' 954' ' ' MET . 2.9 m-85 -55.98 -48.55 75.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.136 0.494 . . . . 0.0 109.951 175.139 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 1.049 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.09 -44.69 3.75 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 119.106 -1.037 . . . . 0.0 111.702 176.829 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 1.049 ' HD3' HG12 ' A' ' 952' ' ' VAL . 89.4 Cg_exo -55.16 -27.98 58.83 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.597 2.198 . . . . 0.0 115.462 172.28 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 1.024 ' HE1' ' HA ' ' A' ' 951' ' ' TYR . 18.6 ptp -69.33 -44.78 70.97 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.182 0.991 . . . . 0.0 108.764 175.853 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.754 ' CG1' ' HA ' ' A' ' 999' ' ' ILE . 59.4 t -59.91 -27.66 39.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.912 169.547 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.5 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 27.6 ttpt -66.39 -33.13 75.02 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.684 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 954' ' ' MET . 5.0 mm-40 -56.06 -45.46 79.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.573 175.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 955' ' ' VAL . 2.8 m -70.51 -24.99 26.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.266 175.293 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.39 -43.79 36.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.824 177.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.9 -24.87 68.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.088 0.471 . . . . 0.0 109.903 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.615 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -65.57 -49.8 67.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.334 173.307 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.846 ' HB2' ' HG ' ' A' ' 995' ' ' LEU . 18.0 tp -59.83 -40.71 89.37 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 172.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -54.87 -55.58 28.89 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.001 0.429 . . . . 0.0 111.15 172.323 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 44.0 m -55.67 -42.44 75.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.723 0.773 . . . . 0.0 110.43 174.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.645 ' CD1' HG21 ' A' ' 929' ' ' VAL . 9.9 tp -54.53 -40.13 68.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.834 176.248 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.85 -33.38 71.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.77 -178.645 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.68 86.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.104 0.478 . . . . 0.0 110.261 175.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.809 HG23 HG11 ' A' ' 925' ' ' VAL . 0.8 OUTLIER -70.65 -34.05 71.63 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.825 175.401 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.7 t -55.81 -30.28 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 173.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.568 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 24.2 t70 -80.85 -29.52 35.81 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 177.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.3 mm-40 -69.41 -42.82 74.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 123.114 1.435 . . . . 0.0 108.186 171.167 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.996 ' HA ' HG21 ' A' ' 975' ' ' VAL . 33.2 t -68.01 -22.73 64.97 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 113.29 -1.777 . . . . 0.0 111.673 174.515 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.774 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.5 tt -58.45 -53.46 65.91 Favored Pre-proline 0 C--O 1.213 -0.854 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.082 179.199 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.61 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 43.5 Cg_exo -59.73 -34.72 95.99 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-N 121.419 1.542 . . . . 0.0 111.911 173.178 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.996 HG21 ' HA ' ' A' ' 972' ' ' SER . 19.7 m -77.23 -10.12 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 118.975 -1.09 . . . . 0.0 111.306 -178.613 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.892 ' HA ' ' HB ' ' A' ' 980' ' ' THR . 3.3 pp -81.98 -40.16 0.95 Allowed Pre-proline 0 CA--C 1.537 0.479 0 CA-C-O 118.307 -0.854 . . . . 0.0 113.187 -177.208 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.464 ' CD ' ' O ' ' A' ' 973' ' ' LEU . 44.1 Cg_endo -69.89 -27.22 26.1 Favored 'Trans proline' 0 C--N 1.36 1.177 0 CA-C-N 121.669 1.632 . . . . 0.0 109.662 172.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.26 9.19 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.554 172.336 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.72 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 18.4 m -167.94 -6.55 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.444 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.892 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 88.2 m -88.07 -23.24 23.79 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -169.643 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.563 ' HA ' HG22 ' A' ' 984' ' ' ILE . 19.8 t60 -50.72 -34.93 28.84 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.002 0.819 . . . . 0.0 111.435 -172.973 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -59.78 -52.95 63.26 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.738 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.721 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.1 tp10 -74.71 -47.95 28.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.92 -178.597 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.718 ' HA ' HG11 ' A' 1038 ' ' VAL . 8.4 tp -54.84 -38.77 45.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -173.261 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.423 ' OE1' ' HA ' ' A' ' 985' ' ' GLU . 5.2 mm-40 -73.13 -27.7 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.881 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.606 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 11.1 ptt? -63.5 -50.52 69.31 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.136 178.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.29 -42.63 22.73 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.745 -178.601 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.44 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 1.0 OUTLIER -61.59 -42.34 98.72 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.028 -173.306 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.541 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 11.0 tmtt? -65.55 -41.39 93.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 175.646 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.76 -50.48 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.167 177.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.617 HD23 HD23 ' A' ' 965' ' ' LEU . 2.9 pp -74.55 -29.32 61.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.761 0.315 . . . . 0.0 111.441 -175.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.48 ' N ' HD11 ' A' ' 991' ' ' LEU . 26.7 t-20 -58.14 -43.38 87.29 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.478 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.5 m -76.34 -27.34 56.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.193 -174.249 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -103.98 -44.76 4.93 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -170.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.981 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.77 -50.18 71.14 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.157 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.582 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -57.51 -45.69 84.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.825 176.796 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.73 -35.38 77.9 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.649 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 1.2 tm? -72.3 -36.21 68.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.903 -174.124 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.754 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 28.7 pt -65.45 -27.05 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.208 0.528 . . . . 0.0 110.46 177.226 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.601 ' O ' ' HB2' ' A' 1004 ' ' LEU . 53.2 m-80 -93.35 -6.14 47.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.692 175.737 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.649 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 20.9 tptt -85.31 -46.83 10.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -175.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.66 ' HE1' ' HE1' ' A' 1021 ' ' MET . 56.9 tpp -79.85 -32.91 40.51 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.36 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.752 ' O ' ' HB2' ' A' 1007 ' ' GLN . 41.7 ttmt -55.28 -49.06 73.06 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.118 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.601 ' HB2' ' O ' ' A' 1000 ' ' ASN . 28.9 tp -53.86 -50.9 65.24 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.901 0.751 . . . . 0.0 112.293 171.288 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.456 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -58.48 -46.45 86.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.251 0.548 . . . . 0.0 110.979 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.54 ' OE1' ' HB3' ' A' ' 948' ' ' PRO . 20.6 mm-40 -77.43 -7.61 56.44 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.314 178.286 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.752 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.2 tp-100 -89.82 -9.41 49.27 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.136 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 57.1 t80 -130.79 13.61 5.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.068 -178.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.542 HG23 ' HG3' ' A' 1014 ' ' GLN . 6.5 p -53.47 108.99 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.435 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 13.9 tpt -147.65 154.3 40.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.153 -178.81 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 58.3 m -51.56 118.69 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.19 0.306 . . . . 0.0 110.972 179.646 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.695 ' O ' ' HG2' ' A' 1015 ' ' GLN . 40.7 t 74.38 -49.1 0.66 Allowed 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.99 0.806 . . . . 0.0 111.481 -177.818 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.435 ' HB2' ' HB3' ' A' 1010 ' ' MET . 3.3 mm? -64.24 -17.66 63.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.542 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -59.16 -43.34 92.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.809 0.338 . . . . 0.0 110.146 178.308 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.695 ' HG2' ' O ' ' A' 1012 ' ' SER . 3.4 pt20 -67.81 -21.82 65.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.822 -175.033 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' 1019 ' ' LYS . 25.8 tt0 -57.89 -55.63 32.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.422 0.629 . . . . 0.0 109.521 174.967 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.479 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 5.7 m-30 -74.94 -15.17 60.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.1 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.556 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 39.3 ttpt -78.19 -42.53 31.19 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.154 -0.219 . . . . 0.0 110.582 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' 1016 ' ' GLU . 17.2 ptpt -69.04 -20.86 64.13 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.615 0.721 . . . . 0.0 109.405 176.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -78.64 -42.74 27.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.086 177.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.66 ' HE1' ' HE1' ' A' 1002 ' ' MET . 3.6 ppp? -74.91 -27.13 60.09 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.38 178.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.1 tp -63.56 -44.09 95.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.159 0.504 . . . . 0.0 110.21 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.1 m -65.87 -31.13 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.575 177.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.85 -35.16 44.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.17 -31.49 72.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.264 177.146 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.484 ' O ' HG22 ' A' 1030 ' ' VAL . 31.0 t60 -67.51 -34.05 76.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.772 174.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -75.76 -41.65 52.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.164 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.981 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.49 -32.05 67.81 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.337 0.589 . . . . 0.0 110.605 179.953 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.602 ' N ' HD22 ' A' 1028 ' ' LEU . . . -56.65 -38.67 72.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.142 0.496 . . . . 0.0 110.314 171.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.484 HG22 ' O ' ' A' 1026 ' ' HIS . 96.2 t -65.81 -34.2 68.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.052 174.594 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.554 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.6 p30 -72.76 -39.86 66.48 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.858 -172.546 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.515 ' HB3' HD22 ' A' ' 932' ' ' LEU . . . -61.05 -54.31 46.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.084 0.468 . . . . 0.0 110.444 174.459 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.415 ' HA ' ' HB3' ' A' 1036 ' ' LEU . 20.0 ttpt -71.74 -22.89 61.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.372 -173.291 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.467 ' O ' HG23 ' A' 1038 ' ' VAL . 9.7 t30 -73.94 -32.32 63.45 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.168 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.673 HD12 HD13 ' A' ' 984' ' ' ILE . 19.6 tp -76.46 -33.61 58.72 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.643 ' HA ' HD11 ' A' 1039 ' ' ILE . 0.0 OUTLIER -48.24 -42.56 30.71 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 174.733 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.633 ' N ' HD12 ' A' 1036 ' ' LEU . 23.1 t70 -72.39 -45.3 60.36 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.174 0.511 . . . . 0.0 110.057 177.147 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.721 HG13 ' HB3' ' A' ' 983' ' ' GLU . 40.8 t -48.32 -63.55 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.684 175.673 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.803 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -78.77 -29.01 14.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.098 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.746 ' H ' HD12 ' A' 1039 ' ' ILE . 1.0 OUTLIER -50.53 -48.49 57.19 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 166.09 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.742 ' O ' ' HG2' ' A' 1045 ' ' LYS . 22.7 mt-30 -74.78 -32.49 62.05 Favored 'General case' 0 C--O 1.2 -1.544 0 CA-C-N 113.413 -1.721 . . . . 0.0 111.22 175.592 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.784 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.28 -55.45 21.28 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 118.763 0.711 . . . . 0.0 112.109 178.778 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.859 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 4.0 tpt180 -54.65 -35.95 64.05 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.418 174.296 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.92 -26.17 59.43 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.297 175.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.742 ' HG2' ' O ' ' A' 1041 ' ' GLN . 73.2 mmtt -65.39 -32.79 74.6 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.701 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.458 ' HB2' HG12 ' A' ' 975' ' ' VAL . 1.7 tmt? -64.45 -40.02 94.93 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.811 175.759 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.11 -37.15 79.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.954 172.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.427 ' HB3' ' O ' ' A' 1045 ' ' LYS . 33.2 t -59.19 -37.52 77.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.107 0.48 . . . . 0.0 110.533 177.026 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.439 HE21 ' HB3' ' A' 1049 ' ' GLN . 1.0 OUTLIER -72.64 -29.47 63.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 25.9 m -84.37 -31.98 24.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.053 -178.559 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 26.7 tpt180 -156.55 105.37 2.0 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.775 179.079 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -88.26 21.27 1.02 Allowed 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.964 2.442 . . . . 0.0 113.138 -176.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.532 -179.873 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.772 ' CD ' ' HB2' ' A' 1044 ' ' LEU . 4.1 ttt-85 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 33.5 m 60.31 15.36 5.33 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.868 0.467 . . . . 0.0 111.923 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 43.06 52.46 5.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 123.522 0.729 . . . . 0.0 110.845 -174.479 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.497 ' CG ' ' H ' ' A' ' 924' ' ' LYS . 23.5 t0 -46.56 -175.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 O-C-N 125.638 1.837 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.645 ' HD2' ' HG1' ' A' ' 968' ' ' THR . 2.9 tmtm? -34.33 -25.23 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.032 0.933 . . . . 0.0 112.46 178.523 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.715 ' HA ' HG22 ' A' ' 968' ' ' THR . 4.5 m -56.52 -50.66 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 174.028 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.483 ' CE2' HD12 ' A' 1036 ' ' LEU . 27.2 t80 -76.94 -35.41 57.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -177.476 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.64 -53.65 54.93 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.607 -1.633 . . . . 0.0 111.546 -177.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.18 -44.99 86.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.203 -173.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.901 ' HB ' HD22 ' A' 1036 ' ' LEU . 16.6 t -60.92 -34.84 61.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.076 -0.649 . . . . 0.0 111.217 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.655 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 87.6 m -60.67 -39.37 88.15 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 173.137 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.61 70.01 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 114.982 -1.008 . . . . 0.0 113.318 174.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.883 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 10.8 tp -68.41 -35.0 77.01 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 109.51 176.361 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.547 ' O ' HG12 ' A' ' 936' ' ' VAL . 45.9 t -70.33 -38.56 74.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.3 0.571 . . . . 0.0 110.028 172.359 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.655 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -64.29 -25.35 68.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.462 177.23 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.592 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -75.37 -29.96 60.04 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.257 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.547 HG12 ' O ' ' A' ' 933' ' ' VAL . 10.2 p -79.7 -13.67 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.043 173.29 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 47.0 mm -73.37 -42.48 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 166.202 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.2 mm-40 -52.6 -41.94 64.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.222 169.273 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.523 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 14.4 ttt -59.09 -41.06 87.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.895 177.756 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 19.9 m -66.25 -37.07 84.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.475 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.1 m -77.67 -40.36 41.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -176.787 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.699 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 5.6 mmtp -62.95 -40.02 96.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.457 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.696 HD11 ' HB3' ' A' ' 946' ' ' ALA . 9.5 tp -73.98 -23.19 18.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 O-C-N 123.127 0.267 . . . . 0.0 111.216 -177.831 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.64 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 77.6 mt-30 -53.52 -54.09 49.52 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.706 177.799 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.64 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 63.1 Cg_endo -100.54 21.66 0.22 Allowed 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.999 1.799 . . . . 0.0 113.473 173.986 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.699 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -89.21 128.57 51.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -173.289 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.446 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 1.8 Cg_endo -84.99 179.2 4.32 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.465 2.777 . . . . 0.0 108.489 159.015 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.567 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 7.1 Cg_endo -50.86 -34.64 46.02 Favored 'Trans proline' 0 C--O 1.245 0.829 0 C-N-CA 122.167 1.912 . . . . 0.0 111.731 178.061 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 17.8 mm-40 -55.6 -37.49 68.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.353 178.224 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.563 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.8 mp0 -96.45 -5.55 39.36 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 178.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.567 ' CD1' ' HA ' ' A' ' 948' ' ' PRO . 10.6 m-85 -57.75 -42.12 83.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 172.713 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.927 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -71.79 -51.98 8.43 Favored Pre-proline 0 CA--C 1.555 1.14 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.246 177.168 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.927 ' HD3' HG13 ' A' ' 952' ' ' VAL . 96.8 Cg_exo -51.42 -41.06 61.4 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.734 2.29 . . . . 0.0 115.135 174.629 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.673 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 14.8 ptt? -60.21 -50.06 75.15 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.706 0.765 . . . . 0.0 110.093 -179.012 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.718 ' HB ' ' HB3' ' A' 1002 ' ' MET . 2.7 t -63.54 -26.82 41.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.785 174.302 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.411 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 39.1 ttmt -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.1 mm-40 -56.0 -46.96 78.58 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.45 174.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.996 HG22 HD21 ' A' ' 998' ' ' LEU . 3.1 m -68.66 -26.27 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.834 177.474 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.438 ' HA2' HD23 ' A' ' 998' ' ' LEU . . . -75.18 -44.11 23.92 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.061 -1.066 . . . . 0.0 112.58 -179.804 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.6 -25.03 64.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.912 0.387 . . . . 0.0 110.482 172.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.883 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.24 -52.98 59.94 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.069 174.645 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 1.035 ' HB2' HD21 ' A' ' 995' ' ' LEU . 18.0 tp -53.3 -44.92 68.7 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.055 0.389 . . . . 0.0 111.213 172.81 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.435 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 30.1 mmm180 -56.26 -54.87 40.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.954 0.407 . . . . 0.0 111.122 177.274 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.4 m -53.81 -43.21 69.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.464 0.65 . . . . 0.0 110.945 174.796 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.587 HD21 HD11 ' A' 1035 ' ' LEU . 36.6 tp -61.92 -37.11 83.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.598 179.157 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.0 tp -52.92 -36.56 59.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.182 178.097 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.06 95.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.151 0.5 . . . . 0.0 110.335 174.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.715 HG22 ' HA ' ' A' ' 925' ' ' VAL . 5.7 m -66.46 -34.02 77.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 174.239 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.634 HG13 HD13 ' A' ' 984' ' ' ILE . 73.3 t -55.25 -31.72 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.509 172.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.597 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.9 t70 -76.63 -22.78 53.65 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.242 177.72 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.654 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 50.7 mm-40 -68.99 -50.79 45.9 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 122.972 1.368 . . . . 0.0 108.587 170.128 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.628 ' OG ' HG22 ' A' ' 980' ' ' THR . 40.3 t -65.53 -24.93 67.24 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.34 177.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.683 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.3 tp -61.11 -48.87 90.83 Favored Pre-proline 0 C--O 1.217 -0.616 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.619 -176.319 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.654 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 32.3 Cg_exo -61.57 -27.98 82.45 Favored 'Trans proline' 0 C--N 1.355 0.876 0 CA-C-N 121.246 1.481 . . . . 0.0 110.578 170.24 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.488 HG21 ' O ' ' A' ' 971' ' ' GLU . 2.6 t -76.86 -10.31 13.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.496 175.676 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.683 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 3.7 tt -68.04 -53.82 18.36 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.226 176.303 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.587 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.5 Cg_exo -62.9 -24.32 74.22 Favored 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 121.437 1.425 . . . . 0.0 111.054 174.36 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -56.83 11.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.585 172.886 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.758 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 4.7 m -169.02 -33.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.975 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.707 HG23 ' HB ' ' A' ' 984' ' ' ILE . 8.3 m -54.99 -19.57 7.11 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -174.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.614 ' HA ' ' HG ' ' A' ' 976' ' ' LEU . 83.5 t60 -48.5 -20.12 0.4 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.363 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 23.6 ttt85 -77.4 -55.52 5.33 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.301 179.203 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.9 ' HB3' HG12 ' A' 1038 ' ' VAL . 0.1 OUTLIER -79.57 -43.76 22.39 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.11 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.707 ' HB ' HG23 ' A' ' 980' ' ' THR . 7.9 tp -56.04 -37.86 50.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.796 -170.406 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 14.7 pt-20 -75.76 -40.71 54.84 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.146 177.034 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.74 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 13.8 ptp -61.25 -50.15 74.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.555 -173.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.6 -32.67 47.64 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.204 -177.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.38 -50.32 72.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.34 -179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -65.16 -32.03 73.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.351 0.596 . . . . 0.0 109.935 175.386 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.649 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.3 tp -61.14 -58.86 6.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.353 176.611 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.791 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 3.1 pp -70.86 -19.05 62.68 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.447 -176.728 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.492 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 6.7 t30 -59.61 -38.17 80.59 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 173.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.415 ' O ' ' HB1' ' A' ' 996' ' ' ALA . 50.5 m -77.6 -30.47 52.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -178.832 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.64 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.4 m-20 -103.36 -27.49 12.4 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 119.629 -0.828 . . . . 0.0 112.4 -175.473 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.035 HD21 ' HB2' ' A' ' 962' ' ' LEU . 7.1 mp -71.8 -15.74 62.16 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 163.088 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . 0.588 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -68.88 -41.82 77.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.308 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 994' ' ' ASP . 7.8 mm-40 -58.26 -33.21 69.15 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.952 171.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.996 HD21 HG22 ' A' ' 958' ' ' VAL . 0.6 OUTLIER -58.33 -35.64 72.19 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.013 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.588 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 1.7 mp -60.24 -42.78 91.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.449 175.4 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.691 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 92.5 m-20 -77.69 -19.37 55.43 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.307 177.284 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.682 ' HD3' ' HA ' ' A' ' 998' ' ' LEU . 9.2 mtpm? -66.9 -44.53 80.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.165 0.507 . . . . 0.0 109.781 174.823 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.89 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 22.3 ptp -76.59 -36.38 57.57 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.775 ' O ' ' HB2' ' A' 1007 ' ' GLN . 23.4 tptm -67.5 -62.59 1.34 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.893 -179.335 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.855 HD22 ' HB3' ' A' 1017 ' ' TYR . 2.9 tt -52.19 -56.17 16.33 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.454 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.75 -53.59 56.14 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.301 -174.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -17.99 64.6 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.169 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.775 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.8 tp-100 -88.56 -38.45 14.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.469 0.652 . . . . 0.0 110.755 -176.491 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.586 ' CD2' ' CE1' ' A' 1017 ' ' TYR . 0.2 OUTLIER -103.37 7.89 38.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.285 -172.476 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.561 ' HA ' ' OE1' ' A' 1014 ' ' GLN . 7.5 p -41.62 124.68 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 114.276 -1.329 . . . . 0.0 113.213 -174.987 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.591 ' SD ' HD12 ' A' 1013 ' ' LEU . 40.1 ttm -150.8 57.09 0.92 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.059 175.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 20.2 m 50.52 -93.54 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.045 -0.98 . . . . 0.0 113.352 175.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 22.7 t -77.73 -27.92 50.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.266 0.555 . . . . 0.0 110.575 -174.162 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.591 HD12 ' SD ' ' A' 1010 ' ' MET . 60.5 mt -78.37 -5.87 53.52 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.621 179.068 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.573 ' NE2' ' HD2' ' A' 1017 ' ' TYR . 8.8 tp60 -60.96 -25.23 66.68 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 121.725 0.774 . . . . 0.0 110.295 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' A' 1018 ' ' LYS . 0.7 OUTLIER -65.54 -41.08 93.42 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.875 -179.473 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -50.22 -52.13 38.53 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.698 173.138 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.855 ' HB3' HD22 ' A' 1004 ' ' LEU . 0.9 OUTLIER -73.96 -19.44 60.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.343 0.592 . . . . 0.0 110.595 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.437 ' HB3' ' O ' ' A' 1015 ' ' GLN . 23.1 tptm -71.34 -46.06 61.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.89 171.179 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -58.05 -56.42 22.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.159 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -47.94 -41.32 24.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.825 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.538 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 2.6 ptp -77.27 -23.34 51.2 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.998 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 67.3 tp -69.05 -39.76 78.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.143 0.497 . . . . 0.0 109.944 179.064 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 20.7 m -64.97 -33.75 76.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.05 175.362 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.34 -26.78 46.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.386 177.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.83 -37.08 73.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.193 177.927 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.487 ' O ' HG21 ' A' 1030 ' ' VAL . 20.3 t60 -66.6 -42.91 86.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.63 175.627 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.65 -51.2 68.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.115 178.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.594 HD13 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -64.75 -33.71 76.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.691 -179.089 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.581 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.06 -43.16 86.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.362 172.908 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' 1026 ' ' HIS . 96.0 t -67.35 -38.97 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 177.186 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.791 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 4.9 m-20 -61.24 -44.49 97.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.846 177.529 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.39 -57.04 12.82 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.964 0.412 . . . . 0.0 110.351 167.651 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' 1036 ' ' LEU . 84.9 mttt -66.22 -22.99 66.35 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -170.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.629 ' O ' HG23 ' A' 1038 ' ' VAL . 66.8 t30 -73.34 -41.15 63.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.776 175.697 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.732 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tm? -75.56 -26.12 57.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.605 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.901 HD22 ' HB ' ' A' ' 929' ' ' VAL . 3.1 tm? -54.35 -52.04 62.86 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.198 169.575 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 18.9 t70 -72.34 -36.17 68.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.646 -178.694 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.9 HG12 ' HB3' ' A' ' 983' ' ' GLU . 18.3 t -51.69 -60.8 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.333 174.373 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.737 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 29.1 pt -89.83 -24.48 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -171.711 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -53.63 -48.25 69.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 162.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.648 ' O ' ' HG2' ' A' 1045 ' ' LYS . 31.7 mt-30 -74.43 -21.65 59.51 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.248 176.366 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.737 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -52.94 -54.04 40.77 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 118.801 0.728 . . . . 0.0 110.625 171.567 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.708 ' HB3' ' HA ' ' A' ' 920' ' ' ARG . 3.3 mpt_? -53.17 -34.79 58.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 173.411 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.772 ' HB2' ' CD ' ' A' ' 920' ' ' ARG . 3.3 tm? -73.73 -34.13 64.64 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.296 173.82 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.758 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.8 mmtt -55.81 -28.31 55.63 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.529 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.4 ttm -72.12 -46.76 55.38 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.185 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.418 ' HB ' HD22 ' A' 1044 ' ' LEU . 41.0 mm -64.69 -41.85 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.821 175.358 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 20.6 t -52.73 -41.58 64.1 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.301 175.782 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 25.1 tm0? -81.18 -30.25 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.357 -178.766 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 36.5 m -76.53 -70.85 0.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.611 -177.878 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -144.98 98.33 4.77 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.488 -175.305 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.79 77.74 2.22 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.788 2.326 . . . . 0.0 112.093 177.632 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 66.3 t60 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.625 -0.703 . . . . 0.0 109.439 -179.609 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.626 ' CG ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.536 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 16.7 m -59.05 141.13 54.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 166.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.744 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.32 82.02 0.15 Allowed 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 122.313 0.245 . . . . 0.0 111.422 -174.444 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 925' ' ' VAL . 3.3 t70 -46.23 -174.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 O-C-N 126.028 2.08 . . . . 0.0 113.055 -170.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.2 tmtp? -42.97 -19.38 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.281 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.882 ' HA ' HG23 ' A' ' 968' ' ' THR . 2.3 m -60.15 -56.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.867 174.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 57.3 t80 -78.67 -25.03 44.82 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.425 1.107 . . . . 0.0 108.508 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 98.3 mt-10 -63.6 -62.82 1.42 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.799 -1.546 . . . . 0.0 111.807 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.42 -32.94 66.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.196 -0.456 . . . . 0.0 112.188 -171.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.819 HG21 HD11 ' A' 1039 ' ' ILE . 19.0 m -60.65 -36.47 70.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.727 0.299 . . . . 0.0 111.512 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.655 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.5 m -61.45 -36.9 81.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 171.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.95 63.24 Favored Glycine 0 CA--C 1.522 0.504 0 CA-C-N 114.558 -1.201 . . . . 0.0 113.279 175.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 1.07 HD12 HD22 ' A' ' 965' ' ' LEU . 3.1 tt -63.86 -50.74 67.64 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.514 ' O ' HG22 ' A' ' 936' ' ' VAL . 39.4 t -58.51 -42.02 83.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.083 0.468 . . . . 0.0 110.316 178.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.655 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -63.19 -28.81 70.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.115 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.564 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . . . -79.37 -25.45 42.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.466 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 0.9 OUTLIER -78.75 -14.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.227 173.814 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.504 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 70.3 mt -69.59 -35.31 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 168.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 13.7 mm-40 -54.59 -38.43 66.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.284 171.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.905 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 44.4 ttm -58.02 -43.36 86.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.144 0.497 . . . . 0.0 110.04 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 14.0 m -68.33 -39.95 81.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.043 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.544 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 17.2 p -76.93 -35.94 56.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -173.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 7.4 mmtp -54.78 -47.92 73.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.516 -1.22 . . . . 0.0 112.147 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.547 ' HB ' ' CE ' ' A' ' 954' ' ' MET . 10.8 tt -71.24 -24.37 24.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.435 -174.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.714 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 85.1 mt-30 -57.52 -57.88 22.14 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.9 Cg_endo -96.2 -16.31 0.38 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.46 1.44 . . . . 0.0 114.124 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -103.35 158.33 32.03 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -171.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.779 ' HG2' ' HG2' ' A' ' 949' ' ' GLU . 84.0 Cg_endo -92.31 -174.97 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 123.804 3.003 . . . . 0.0 113.155 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.628 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 81.7 Cg_exo -49.83 -31.64 27.05 Favored 'Trans proline' 0 C--N 1.363 1.291 0 C-N-CA 123.719 2.946 . . . . 0.0 114.885 -178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.779 ' HG2' ' HG2' ' A' ' 947' ' ' PRO . 11.7 pt-20 -55.48 -29.5 58.88 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.634 176.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 51.0 mm-40 -98.14 -5.54 33.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.604 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.779 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.8 m-85 -55.0 -46.08 75.12 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.994 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -70.1 -51.96 13.36 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 119.267 -0.973 . . . . 0.0 112.324 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.994 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.9 Cg_exo -53.04 -31.98 56.32 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.731 2.287 . . . . 0.0 115.158 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.905 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.7 ptp -64.8 -39.83 94.23 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.021 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.636 ' O ' HG22 ' A' ' 958' ' ' VAL . 65.7 t -67.12 -28.01 41.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.917 169.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.9 tptm -65.25 -33.82 76.89 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.6 mm-40 -56.31 -47.38 78.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.971 174.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 955' ' ' VAL . 3.2 m -70.36 -25.15 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.437 174.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.734 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.03 -45.81 61.28 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.083 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.425 ' O ' HD13 ' A' ' 960' ' ' LEU . 2.3 tm? -62.35 -30.49 71.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.961 0.41 . . . . 0.0 109.917 171.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.734 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.18 -57.01 14.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.072 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.946 ' HB2' HD13 ' A' ' 995' ' ' LEU . 2.9 tm? -60.55 -40.62 92.22 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.578 177.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -50.39 -56.59 10.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.555 0.693 . . . . 0.0 110.894 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.9 m -53.35 -40.51 64.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.238 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 1.07 HD22 HD12 ' A' ' 932' ' ' LEU . 6.3 mp -68.3 -27.22 66.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.523 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.8 tt -56.96 -36.13 69.94 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.53 97.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.284 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.882 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -62.23 -41.4 98.37 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.809 173.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 965' ' ' LEU . 87.9 t -55.11 -31.85 26.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.927 174.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.9 t70 -75.84 -34.09 60.08 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.129 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.578 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.8 mm-40 -59.73 -53.13 61.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.515 1.15 . . . . 0.0 108.762 172.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.463 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.0 t -67.57 -22.3 65.4 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.756 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.716 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 28.7 tp -53.3 -55.62 32.57 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 118.579 -0.725 . . . . 0.0 112.144 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.716 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 35.4 Cg_exo -63.8 -23.8 68.8 Favored 'Trans proline' 0 C--N 1.358 1.069 0 CA-C-N 121.127 1.438 . . . . 0.0 111.02 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.532 HG13 ' HB2' ' A' 1046 ' ' MET . 11.5 t -77.51 -8.62 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.162 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.622 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -83.47 -40.14 0.77 Allowed Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.363 -0.836 . . . . 0.0 111.951 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.622 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 18.3 Cg_endo -63.99 -23.91 67.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 120.797 1.321 . . . . 0.0 110.133 168.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 978' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 975' ' ' VAL . . . -64.87 -62.68 1.42 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.148 169.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.867 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.4 m -165.76 -32.31 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.687 HG22 ' HB ' ' A' ' 984' ' ' ILE . 3.4 m -57.27 -18.22 15.47 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.649 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.0 p-80 -48.71 -20.75 0.5 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -174.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -70.97 -57.41 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.486 177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.951 ' HG2' HG22 ' A' 1038 ' ' VAL . 0.0 OUTLIER -82.91 -34.5 26.61 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -178.193 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.687 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.2 tp -61.76 -24.48 34.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -74.78 -48.98 22.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 168.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.733 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 10.6 ptp -63.84 -44.81 92.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.781 -171.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.782 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.71 -46.01 19.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 1.077 ' HA ' HD12 ' A' ' 991' ' ' LEU . 22.8 tm0? -62.87 -43.77 97.91 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.87 -175.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 54.3 mttp -62.33 -33.9 75.59 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.341 0.591 . . . . 0.0 109.7 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.552 ' HG ' ' CB ' ' A' 1031 ' ' ASP . 3.6 tp -71.49 -38.82 71.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.744 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.077 HD12 ' HA ' ' A' ' 988' ' ' GLN . 5.6 mt -61.79 -51.59 67.66 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.493 0.663 . . . . 0.0 109.451 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.49 -45.12 77.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.065 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.67 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 50.0 m -64.64 -48.44 74.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.168 -177.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.34 -40.13 8.06 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -167.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.053 ' HA ' HD12 ' A' 1028 ' ' LEU . 3.5 tt -60.99 -41.14 95.9 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.723 175.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -61.43 -42.57 98.95 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 993' ' ' SER . 68.4 mm-40 -52.39 -48.35 65.69 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.088 175.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.536 ' O ' HG11 ' A' ' 955' ' ' VAL . 4.0 mm? -58.55 -37.26 75.32 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 110.191 -175.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -58.04 -44.43 87.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.195 -178.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.701 ' O ' ' HB2' ' A' 1004 ' ' LEU . 16.6 m-80 -93.81 -11.17 31.86 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.483 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.485 ' HD3' ' HA ' ' A' 1001 ' ' LYS . 36.1 mmtm -85.97 -40.66 15.61 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.281 -0.168 . . . . 0.0 111.316 -176.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.683 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 42.5 tpp -77.44 -36.5 53.01 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 172.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.82 ' O ' ' HB2' ' A' 1007 ' ' GLN . 63.0 tttp -53.87 -53.4 53.05 Favored 'General case' 0 C--O 1.211 -0.939 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 171.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.701 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.7 tt -53.06 -52.2 59.31 Favored 'General case' 0 C--O 1.22 -0.482 0 O-C-N 123.932 0.77 . . . . 0.0 111.336 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.464 ' O ' ' HD2' ' A' 1017 ' ' TYR . . . -55.76 -52.22 64.7 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.09 0.472 . . . . 0.0 109.939 -178.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.551 ' HG3' ' HB2' ' A' ' 951' ' ' TYR . 23.2 mm-40 -72.74 -9.83 59.09 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.626 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.82 ' HB2' ' O ' ' A' 1003 ' ' LYS . 6.2 tp60 -95.34 -27.44 15.46 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.399 0.619 . . . . 0.0 110.823 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 23.4 t80 . . . . . 0 C--N 1.315 -0.926 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.406 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 . . . . . 0 N--CA 1.461 0.1 0 CA-C-O 121.452 0.644 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' 1019 ' ' LYS . 12.4 pt20 -70.22 -26.6 63.94 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.918 -177.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.74 -53.82 46.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.586 0.231 . . . . 0.0 110.875 166.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.464 ' HD2' ' O ' ' A' 1005 ' ' ALA . 0.4 OUTLIER -64.1 -25.16 67.98 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.434 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.529 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 28.8 tptp -74.42 -25.29 59.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.389 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' 1015 ' ' GLN . 34.7 mmtp -68.55 -57.67 5.43 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -50.26 -35.08 25.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.323 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.423 ' HE2' ' HB2' ' A' 1025 ' ' ALA . 1.7 tmt? -66.4 -43.58 85.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.765 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 41.3 tp -64.49 -39.25 93.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.756 0.312 . . . . 0.0 110.954 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 41.1 m -63.05 -32.88 74.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.596 0.713 . . . . 0.0 110.335 175.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.513 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.12 -39.77 40.23 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.812 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.423 ' HB2' ' HE2' ' A' 1021 ' ' MET . . . -60.4 -35.18 75.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.78 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 11.2 t-80 -62.97 -39.2 93.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.898 174.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.8 82.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.52 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.053 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.94 -34.28 71.32 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.317 0.579 . . . . 0.0 110.296 179.297 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.631 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.59 -32.78 65.56 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.629 -0.67 . . . . 0.0 110.666 171.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 99.3 t -71.7 -27.99 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.68 175.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.552 ' CB ' ' HG ' ' A' ' 990' ' ' LEU . 2.5 p30 -74.27 -40.92 62.01 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.632 -0.827 . . . . 0.0 109.478 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -60.28 -49.65 76.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.69 ' O ' ' HG ' ' A' 1036 ' ' LEU . 54.1 tptt -59.97 -49.48 77.53 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.787 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' 1038 ' ' VAL . 65.9 t30 -62.76 -43.61 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.378 -176.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 991' ' ' LEU . 19.1 tp -72.82 -38.08 67.29 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.031 -175.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.74 ' HA ' HG21 ' A' ' 929' ' ' VAL . 3.5 pp -61.0 -19.55 61.45 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 120.688 0.28 . . . . 0.0 110.586 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -98.52 -33.96 10.79 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.951 HG22 ' HG2' ' A' ' 983' ' ' GLU . 19.9 t -53.11 -58.9 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.875 172.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.838 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -83.19 -24.32 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.749 -177.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.697 ' H ' HD12 ' A' 1039 ' ' ILE . 8.6 t70 -58.12 -42.21 85.26 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 163.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' 1045 ' ' LYS . 36.5 mt-30 -68.29 -34.73 76.7 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.888 172.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.756 ' HA ' ' HG2' ' A' 1045 ' ' LYS . . . -52.39 -51.61 58.1 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.891 0.377 . . . . 0.0 110.952 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.744 ' HG3' ' HA ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER -47.28 -41.48 18.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.378 172.102 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.697 ' N ' ' HD3' ' A' 1043 ' ' ARG . 28.0 tp -80.37 -26.64 38.51 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.966 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.867 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.0 mmmt -64.32 -39.94 94.92 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.532 ' HB2' HG13 ' A' ' 975' ' ' VAL . 13.7 tmm? -63.2 -43.32 98.48 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.705 176.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 41.8 mm -62.71 -44.17 99.25 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 173.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.6 m -47.83 -45.17 29.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.596 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 120.883 0.373 . . . . 0.0 111.531 179.702 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 4.9 tpp180 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.4 m -86.37 50.56 2.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.538 ' H ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER 42.3 52.45 4.58 Favored 'General case' 0 CA--C 1.498 -1.051 0 C-N-CA 123.494 0.717 . . . . 0.0 111.728 176.1 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.9 t70 -46.77 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 O-C-N 125.694 1.871 . . . . 0.0 112.742 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.729 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.5 tmtp? -36.4 -21.16 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 124.212 1.005 . . . . 0.0 112.519 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.743 ' HA ' HG23 ' A' ' 968' ' ' THR . 19.2 m -60.49 -53.84 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 C-N-CA 123.284 0.634 . . . . 0.0 112.364 175.212 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.451 ' N ' HG23 ' A' ' 925' ' ' VAL . 38.5 t80 -79.77 -37.37 35.5 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 122.084 0.945 . . . . 0.0 108.908 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 45.7 mt-10 -58.37 -54.84 42.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.703 -178.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.729 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 65.6 t30 -73.68 -33.01 64.24 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -172.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.644 HG11 ' N ' ' A' 1036 ' ' LEU . 21.3 t -63.06 -32.97 58.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.567 172.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.633 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.8 m -61.31 -35.83 78.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 170.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.87 -31.97 69.27 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.18 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.932 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.5 tt -64.12 -38.4 90.92 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.606 ' HA ' HG12 ' A' ' 936' ' ' VAL . 22.0 t -69.4 -41.49 80.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.933 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -58.67 -35.29 72.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.177 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.38 -24.78 42.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.788 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.606 HG12 ' HA ' ' A' ' 933' ' ' VAL . 9.1 p -83.12 -15.39 11.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.406 171.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -68.94 -37.72 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 165.072 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.743 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.0 mm-40 -52.48 -36.88 55.95 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.744 169.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.3 tmm? -60.99 -41.92 97.4 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.579 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 50.2 m -73.82 -31.26 63.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.735 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 938' ' ' GLU . 22.9 p -77.05 -43.35 34.79 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.691 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.3 mmtp -52.76 -53.24 50.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.187 174.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.854 HG13 ' HE1' ' A' ' 951' ' ' TYR . 14.2 tt -63.58 -23.62 33.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.8 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 27.2 mt-30 -55.39 -62.79 3.84 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.319 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.8 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 44.4 Cg_endo -97.31 25.47 0.24 Allowed 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 121.631 1.554 . . . . 0.0 114.028 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.887 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -113.58 138.8 22.73 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.66 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 69.0 Cg_endo -88.38 -174.07 1.03 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 123.611 2.874 . . . . 0.0 109.972 165.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.783 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 8.1 Cg_endo -51.87 -31.92 44.84 Favored 'Trans proline' 0 C--O 1.247 0.935 0 C-N-CA 122.4 2.067 . . . . 0.0 112.361 176.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.42 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 48.1 mt-10 -52.75 -38.56 61.12 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.775 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.887 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 44.2 mt-10 -104.49 6.42 34.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.854 ' HE1' HG13 ' A' ' 943' ' ' ILE . 5.4 m-30 -66.5 -38.3 86.93 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 170.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.112 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -75.87 -47.72 3.79 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.211 174.17 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.112 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.2 Cg_exo -55.28 -26.5 52.5 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.719 1.612 . . . . 0.0 114.943 172.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.644 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 16.8 ptp -73.37 -36.01 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.596 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.972 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -64.08 -27.47 42.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.424 169.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 20.7 ttmm -58.49 -38.45 77.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 175.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.429 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 4.9 mm-40 -57.87 -48.18 80.58 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.271 178.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 936' ' ' VAL . 6.1 m -73.3 -22.61 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 O-C-N 122.205 -0.31 . . . . 0.0 111.198 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.473 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.29 -44.42 34.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.224 -0.989 . . . . 0.0 111.459 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.28 -26.83 68.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.389 171.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.932 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.28 -54.4 37.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 174.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 965' ' ' LEU . 3.4 tm? -62.09 -37.15 83.97 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 959' ' ' GLY . 34.1 mmt180 -56.25 -60.22 3.81 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 172.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 2.1 p -52.79 -40.76 63.5 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.194 0.521 . . . . 0.0 110.211 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 962' ' ' LEU . 2.7 tm? -57.05 -35.29 69.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.026 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.45 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 48.6 tp -64.64 -29.04 70.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -178.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.58 96.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.178 0.513 . . . . 0.0 110.097 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.743 HG23 ' HA ' ' A' ' 925' ' ' VAL . 4.5 m -64.24 -35.97 82.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.628 173.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.737 HG13 HD11 ' A' ' 984' ' ' ILE . 83.1 t -54.95 -31.09 24.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.726 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.534 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -74.87 -28.3 60.6 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 120.528 0.204 . . . . 0.0 111.485 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 23.8 mm-40 -64.79 -53.99 38.25 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 123.027 1.394 . . . . 0.0 108.543 172.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.478 ' HB3' HG23 ' A' 1039 ' ' ILE . 10.4 p -67.24 -22.15 65.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.888 -1.505 . . . . 0.0 111.301 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.708 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 44.6 tp -54.34 -54.67 45.49 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-O 118.938 -0.553 . . . . 0.0 112.127 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 31.3 Cg_exo -62.39 -25.39 76.22 Favored 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 121.3 1.333 . . . . 0.0 110.941 171.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 980' ' ' THR . 49.4 t -73.6 -12.88 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.567 174.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.779 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 4.9 tt -74.46 -53.96 3.29 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.557 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.3 Cg_exo -62.36 -22.26 73.84 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.111 1.207 . . . . 0.0 110.693 173.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 978' ' ' ALA . . . . . 0.543 ' HA ' ' HG3' ' A' 1049 ' ' GLN . . . -70.35 -65.13 0.77 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.101 173.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.1 m -161.38 -32.76 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.788 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -172.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.656 HG22 ' HA ' ' A' ' 976' ' ' LEU . 1.4 t -66.27 -13.82 61.02 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -173.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.779 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 42.4 t60 -49.83 -21.82 1.26 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.879 0.471 . . . . 0.0 112.097 -174.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.562 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 6.1 ptp180 -78.68 -53.43 7.16 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.024 0.44 . . . . 0.0 110.634 176.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.812 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.2 OUTLIER -77.48 -46.27 23.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -175.419 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.737 HD11 HG13 ' A' ' 969' ' ' VAL . 11.8 tt -55.45 -34.56 34.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.119 0.485 . . . . 0.0 110.112 -174.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -72.94 -34.26 66.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.305 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.624 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 23.1 ptm -66.22 -58.04 6.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.332 -0.547 . . . . 0.0 112.006 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.603 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.42 -36.29 33.91 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 6.5 tp60 -67.15 -36.25 81.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.774 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -66.86 -31.41 71.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.596 0.712 . . . . 0.0 109.123 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.425 HD11 ' CG ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -71.45 -39.44 70.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.628 178.315 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.797 ' HA ' ' OD1' ' A' ' 994' ' ' ASP . 47.3 mt -74.03 -29.12 61.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.299 -176.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -60.95 -43.62 98.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 15.5 m -77.65 -33.85 53.34 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.804 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.797 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p-10 -91.37 -38.07 12.83 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.853 -0.529 . . . . 0.0 111.247 -170.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.518 ' HA ' ' CD1' ' A' 1028 ' ' LEU . 2.7 tm? -59.01 -37.13 76.2 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.586 ' O ' HG22 ' A' ' 999' ' ' ILE . . . -59.93 -51.85 67.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.224 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' 1001 ' ' LYS . 2.8 pt-20 -63.7 -35.23 79.88 Favored 'General case' 0 C--O 1.215 -0.731 0 C-N-CA 118.688 -1.205 . . . . 0.0 110.105 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.557 HD11 ' CA ' ' A' 1025 ' ' ALA . 1.8 mm? -69.43 -42.34 75.14 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.689 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.808 ' HA ' HG11 ' A' ' 955' ' ' VAL . 17.4 tt -59.65 -25.36 31.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.009 0.433 . . . . 0.0 110.804 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.691 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.0 OUTLIER -104.03 -7.71 20.1 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.987 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 31.0 mmtp -83.48 -37.69 22.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.972 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 18.9 mmt -72.91 -41.97 64.04 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.735 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.8 ttpt -58.13 -48.71 79.38 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 114.275 -1.33 . . . . 0.0 109.639 172.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1000 ' ' ASN . 45.7 tp -58.5 -45.74 88.14 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.7 ' HB1' HE22 ' A' 1014 ' ' GLN . . . -63.77 -49.3 73.5 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.372 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.2 pp0? -67.24 -17.64 64.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.901 176.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.735 ' HB2' ' O ' ' A' 1003 ' ' LYS . 33.9 tp60 -77.77 -33.64 52.65 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.6 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.564 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 17.4 t80 . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.393 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.75 ' HG3' ' HE2' ' A' ' 951' ' ' TYR . 0.6 OUTLIER . . . . . 0 N--CA 1.444 -0.772 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.557 ' O ' ' HG3' ' A' 1019 ' ' LYS . 45.0 mt-30 -59.8 -48.28 82.3 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -156.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -50.88 -52.13 44.83 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 111.309 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.58 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.7 m-30 -72.09 -24.72 61.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.849 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.673 ' HA ' ' HB3' ' A' 1021 ' ' MET . 24.3 tttt -67.92 -31.28 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.655 0.264 . . . . 0.0 110.52 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' 1015 ' ' GLN . 84.1 mttt -61.45 -57.67 11.28 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.433 ' H ' ' HG3' ' A' 1020 ' ' GLN . 54.2 mt-30 -50.58 -45.44 57.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.999 172.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.673 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 6.4 ttt -56.41 -54.05 50.14 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.527 0.731 . . . . 0.0 112.0 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.93 -45.22 90.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.644 -175.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 17.0 m -61.22 -32.42 72.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.332 0.587 . . . . 0.0 110.612 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.498 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.23 -43.56 28.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.98 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.557 ' CA ' HD11 ' A' ' 998' ' ' LEU . . . -59.1 -31.48 68.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.927 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -70.0 -38.44 75.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.435 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -59.95 -44.11 94.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 174.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.717 ' HA ' ' OD2' ' A' ' 994' ' ' ASP . 1.9 tt -61.76 -54.86 36.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.58 0.705 . . . . 0.0 110.427 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.603 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -56.49 -36.83 69.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.949 -176.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1030 ' ' VAL . . . . . . . . . . . . . 70.4 t -75.2 -41.68 44.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.808 0.337 . . . . 0.0 110.602 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.471 ' O ' HD21 ' A' ' 991' ' ' LEU . 43.6 m-20 -67.05 -30.0 69.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -52.23 -50.91 61.05 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 164.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' 1036 ' ' LEU . 58.1 mtmt -64.22 -17.41 63.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.596 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' 1038 ' ' VAL . 59.5 t30 -75.38 -37.3 60.65 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.013 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 991' ' ' LEU . 33.3 tp -75.27 -20.44 59.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.644 ' N ' HG11 ' A' ' 929' ' ' VAL . 45.9 tp -57.75 -51.09 71.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.28 174.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -31.46 67.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.728 178.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.812 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 18.6 t -60.69 -62.45 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.005 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.696 HG22 ' HB ' ' A' ' 925' ' ' VAL . 1.8 mt -77.6 -24.8 14.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.343 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.546 ' O ' ' HB3' ' A' 1043 ' ' ARG . 18.0 t70 -61.81 -37.88 86.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.798 165.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.71 ' O ' ' HG2' ' A' 1045 ' ' LYS . 13.3 mm100 -70.74 -32.33 69.46 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.076 171.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.531 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.81 -45.3 74.36 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 121.353 0.597 . . . . 0.0 110.081 171.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.58 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.09 -50.19 15.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.127 170.938 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.509 ' N ' ' HD3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -79.64 -20.88 45.68 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.374 -0.204 . . . . 0.0 111.416 178.657 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.783 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 38.0 mmtm -65.22 -40.4 94.03 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.67 -44.45 96.45 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.946 -1.024 . . . . 0.0 109.412 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.427 ' HB ' HD23 ' A' 1044 ' ' LEU . 43.8 mm -64.59 -48.22 85.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.442 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -35.28 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.125 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1049 ' ' GLN . . . . . 0.543 ' HG3' ' HA ' ' A' ' 978' ' ' ALA . 1.1 tm0? . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.847 ' HE ' ' HA ' ' A' ' 920' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.734 0.302 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -82.49 47.48 1.17 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.564 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.453 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 46.84 72.03 0.27 Allowed 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.951 0.9 . . . . 0.0 113.035 174.53 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.941 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 1.9 t70 -45.44 -175.5 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 O-C-N 125.624 1.828 . . . . 0.0 112.873 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.529 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.1 tmtp? -42.56 -22.66 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.388 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.858 ' HA ' HG23 ' A' ' 968' ' ' THR . 15.5 m -56.64 -51.61 63.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.27 174.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.436 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 5.0 t80 -77.61 -34.43 53.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.179 -1.008 . . . . 0.0 109.348 -175.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -61.68 -49.25 77.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.418 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.437 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.5 -38.21 77.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.539 -176.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 1.073 ' HA ' HD13 ' A' ' 932' ' ' LEU . 2.9 t -66.0 -29.67 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.846 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 38.6 m -61.67 -40.28 94.41 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.08 -27.63 60.16 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 114.568 -1.197 . . . . 0.0 113.351 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 1.101 HD11 ' HB2' ' A' ' 965' ' ' LEU . 10.0 mp -64.13 -41.88 97.05 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 117.86 0.83 . . . . 0.0 109.745 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.592 ' O ' HG23 ' A' ' 937' ' ' ILE . 77.9 t -70.59 -35.38 61.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.307 0.575 . . . . 0.0 109.909 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.2 mmpt? -67.12 -19.14 65.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.168 0.509 . . . . 0.0 109.971 174.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -83.0 -26.54 31.14 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.653 175.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.569 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.5 p -88.13 -15.09 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 120.131 -0.627 . . . . 0.0 110.274 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.592 HG23 ' O ' ' A' ' 933' ' ' VAL . 21.0 pt -75.38 -31.84 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 167.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.9 mm-40 -56.22 -44.84 79.92 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.873 166.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.758 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 26.1 ttt -59.16 -38.98 81.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.726 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.553 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.6 m -67.82 -40.94 83.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.826 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.569 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.4 t -76.05 -41.46 50.62 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -175.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.625 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 10.1 mmtm -47.31 -54.03 12.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.876 176.168 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.629 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 13.6 tt -71.23 -21.51 21.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.548 -174.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.796 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 14.2 mm100 -54.74 -63.02 3.24 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.796 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 93.4 Cg_endo -98.69 -5.64 0.75 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.699 1.599 . . . . 0.0 114.178 -176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -111.7 151.63 43.53 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.502 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 90.3 Cg_endo -78.79 -176.61 3.37 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.563 2.842 . . . . 0.0 112.796 -176.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.732 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 75.3 Cg_exo -51.98 -25.75 23.03 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 123.133 2.555 . . . . 0.0 113.35 175.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.411 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 30.1 mm-40 -56.82 -30.7 63.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.829 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.682 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.9 mp0 -97.63 -1.05 44.56 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.641 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.732 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -57.48 -40.69 79.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 170.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.045 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -74.98 -52.45 3.26 Favored Pre-proline 0 CA--C 1.554 1.133 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.115 177.112 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.045 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.72 -32.33 45.03 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.089 1.859 . . . . 0.0 115.031 172.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.758 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 27.3 ptt? -68.53 -44.54 74.38 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.921 -0.711 . . . . 0.0 110.227 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.683 ' HB ' ' HB3' ' A' 1002 ' ' MET . 70.2 t -66.23 -26.46 38.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.032 170.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 1.6 tmtp? -59.67 -36.99 77.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.2 mm-40 -55.96 -47.35 77.79 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.707 175.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 3.2 m -73.89 -22.06 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 120.762 0.315 . . . . 0.0 111.241 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.68 -43.47 59.87 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.022 175.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.1 tp -60.29 -23.14 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.345 -0.427 . . . . 0.0 110.512 171.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.856 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.99 -56.36 15.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.776 177.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 991' ' ' LEU . 13.9 tp -62.59 -38.67 91.06 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.987 176.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 20.4 tpp180 -51.4 -62.64 1.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 0.0 111.68 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 20.5 p -56.2 -36.82 68.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.841 0.353 . . . . 0.0 110.927 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 1.101 ' HB2' HD11 ' A' ' 932' ' ' LEU . 31.0 tp -58.08 -34.0 69.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.083 176.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 1.142 ' HA ' HG22 ' A' ' 969' ' ' VAL . 4.1 tt -70.32 -24.08 62.95 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.726 -0.389 . . . . 0.0 111.154 -177.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.96 95.87 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 167.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.858 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -69.36 -42.04 75.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.077 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 1.142 HG22 ' HA ' ' A' ' 966' ' ' LEU . 32.9 m -62.44 -26.34 40.19 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.561 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 18.5 t70 -73.25 -22.9 60.3 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.541 173.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.6 mm-40 -74.49 -49.94 20.2 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-O 122.113 0.959 . . . . 0.0 109.296 169.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.628 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 93.6 p -63.9 -26.46 68.61 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.929 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 1.061 ' HA ' HD13 ' A' ' 976' ' ' LEU . 0.9 OUTLIER -59.44 -52.26 75.49 Favored Pre-proline 0 N--CA 1.472 0.647 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.383 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.646 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 52.6 Cg_exo -57.2 -26.02 67.53 Favored 'Trans proline' 0 C--N 1.354 0.859 0 CA-C-N 120.687 1.281 . . . . 0.0 110.392 170.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' 1046 ' ' MET . 1.8 t -78.79 -18.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.416 175.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 1.061 HD13 ' HA ' ' A' ' 973' ' ' LEU . 8.5 mp -52.66 -58.42 11.99 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 118.147 0.43 . . . . 0.0 110.265 172.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.63 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 64.4 Cg_exo -54.81 -38.33 92.11 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 121.839 1.693 . . . . 0.0 111.962 174.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.74 -50.18 74.08 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.111 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.598 ' CB ' ' HG3' ' A' 1045 ' ' LYS . 31.1 t 179.63 -26.43 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.871 0.367 . . . . 0.0 111.287 -179.141 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.64 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 89.9 m -51.56 -21.0 2.2 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -177.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -52.86 -20.13 3.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.675 0.274 . . . . 0.0 111.358 -177.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -76.83 -51.66 10.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.949 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.971 ' HB2' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -65.7 -54.86 21.62 Favored 'General case' 0 CA--C 1.494 -1.205 0 CA-C-O 122.063 0.935 . . . . 0.0 112.142 178.859 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.947 HG21 ' HG ' ' A' ' 976' ' ' LEU . 9.2 tp -63.73 -34.15 66.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 113.713 -1.585 . . . . 0.0 110.097 -164.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -60.1 -45.39 93.13 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.966 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.55 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 24.5 ptm -73.61 -52.94 11.69 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.201 -175.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.621 ' HB3' HD23 ' A' 1035 ' ' LEU . . . -78.65 -44.94 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -172.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.705 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 6.3 tp60 -63.44 -44.09 95.54 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.068 -0.253 . . . . 0.0 111.148 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -67.46 -31.92 72.41 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.482 0.658 . . . . 0.0 109.655 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 986' ' ' MET . 0.3 OUTLIER -64.52 -50.86 65.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.465 175.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 962' ' ' LEU . 3.5 pp -74.2 -27.35 60.76 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.609 -175.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.545 ' N ' HD12 ' A' ' 991' ' ' LEU . 54.6 t30 -58.17 -42.1 85.29 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.458 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 13.5 m -77.82 -28.36 50.23 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.947 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.26 -43.18 8.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -172.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.01 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.88 -44.46 70.47 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 169.336 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -53.86 -45.76 71.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.258 177.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.701 ' O ' ' HG2' ' A' 1001 ' ' LYS . 22.1 mm-40 -61.36 -34.79 75.88 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 121.676 -0.64 . . . . 0.0 111.675 178.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.677 ' HG ' HD13 ' A' 1028 ' ' LEU . 2.4 mm? -69.31 -34.76 75.16 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.02 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 996' ' ' ALA . 19.9 pt -73.68 -13.36 15.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.938 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.657 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 4.8 p30 -104.15 -3.77 23.99 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.701 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 42.2 mmtm -85.71 -30.61 23.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 170.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.005 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 25.0 ptt? -72.92 -38.1 66.97 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 171.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.785 ' O ' ' HB2' ' A' 1007 ' ' GLN . 17.7 tppt? -63.02 -53.87 47.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.923 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.586 HD12 ' HD3' ' A' 1001 ' ' LYS . 17.1 mt -56.13 -46.81 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.495 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.44 -46.97 88.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.626 0.727 . . . . 0.0 110.373 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.436 ' NE2' HG11 ' A' ' 952' ' ' VAL . 0.3 OUTLIER -75.92 -10.36 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.627 0.727 . . . . 0.0 110.03 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.785 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.3 tp60 -88.74 -27.14 21.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.418 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 14.6 t80 . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.58 -179.193 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 120.895 0.379 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.657 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 28.8 pt20 -54.86 -35.26 63.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.064 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.414 ' HA ' ' HE2' ' A' 1019 ' ' LYS . 37.7 tt0 -51.39 -52.56 44.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.826 0.346 . . . . 0.0 111.311 172.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.52 ' CE2' HD22 ' A' 1004 ' ' LEU . 3.2 m-85 -74.99 -21.24 59.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.976 0.417 . . . . 0.0 110.67 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.657 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 81.5 tttt -66.79 -47.0 73.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.452 176.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.414 ' HE2' ' HA ' ' A' 1016 ' ' GLU . 65.6 pttt -73.65 -19.53 60.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.047 0.451 . . . . 0.0 110.719 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -80.31 -33.3 37.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.546 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 43.5 ttp -71.66 -39.89 70.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.27 174.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.84 -48.86 72.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.151 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -62.17 -33.29 74.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.406 0.622 . . . . 0.0 110.65 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -76.07 -36.2 59.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.884 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.546 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -61.48 -36.5 80.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.493 178.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' 1030 ' ' VAL . 60.2 t60 -63.3 -35.83 81.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.885 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.59 68.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.335 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.01 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.61 -30.66 67.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.281 0.563 . . . . 0.0 110.276 178.003 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.503 ' N ' HD23 ' A' 1028 ' ' LEU . . . -55.84 -40.23 72.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 170.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' 1026 ' ' HIS . 75.1 t -66.95 -33.47 63.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.035 175.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.568 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.2 p30 -70.73 -41.95 71.2 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.295 -177.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.8 66.84 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 171.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 60.1 tttp -59.52 -39.84 85.18 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.748 ' O ' HG23 ' A' 1038 ' ' VAL . 20.9 t-20 -68.43 -49.11 62.31 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 121.05 0.453 . . . . 0.0 110.282 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 987' ' ' ALA . 3.3 tm? -67.54 -36.36 80.84 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.427 ' N ' HG11 ' A' ' 929' ' ' VAL . 5.2 tt -49.19 -44.11 42.79 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.321 0.649 . . . . 0.0 111.812 175.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' 1040 ' ' ASP . 24.3 t70 -89.0 -41.57 12.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.85 -176.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.971 HG12 ' HB2' ' A' ' 983' ' ' GLU . 3.3 t -74.26 -29.42 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' OE1' ' A' ' 983' ' ' GLU . 1.5 tt -81.14 -31.32 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.401 0.68 . . . . 0.0 110.302 170.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.486 ' HB3' ' O ' ' A' 1037 ' ' ASP . 35.3 t0 -52.78 -38.9 61.75 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 161.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' 1038 ' ' VAL . 49.8 mt-30 -76.27 -25.38 54.87 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.887 174.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.739 ' HB2' ' OE1' ' A' ' 983' ' ' GLU . . . -52.42 -56.31 15.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.709 1.141 . . . . 0.0 110.428 168.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.941 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 2.7 tpt180 -60.66 -29.77 69.48 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.464 178.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.5 tp -78.46 -25.36 45.84 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.37 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.598 ' HG3' ' CB ' ' A' ' 979' ' ' SER . 3.4 mptp? -62.23 -35.98 80.59 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.886 0.875 . . . . 0.0 109.504 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.77 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.7 tmt? -69.48 -42.31 74.98 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.223 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.483 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.9 mm -60.62 -31.75 49.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.719 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.8 m -64.79 -28.59 69.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.119 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.947 0.403 . . . . 0.0 110.469 178.259 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.814 ' HD2' ' HB2' ' A' 1044 ' ' LEU . 15.0 ttt180 . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 121.089 0.471 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 3.0 t -111.31 29.27 7.96 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.447 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 48.27 59.45 4.28 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.738 -175.422 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.0 t70 -47.33 -173.54 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 O-C-N 125.631 1.832 . . . . 0.0 112.363 -176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.52 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.3 tmtp? -37.78 -25.05 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.374 1.07 . . . . 0.0 112.067 -177.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.722 ' HB ' HG13 ' A' 1039 ' ' ILE . 10.3 m -59.9 -49.79 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.059 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 62.2 t80 -75.93 -40.3 54.42 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.208 -178.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.96 -47.88 84.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.225 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.4 t-20 -72.18 -42.93 65.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.786 -173.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.66 ' CG2' HD11 ' A' 1039 ' ' ILE . 47.1 t -65.02 -30.17 49.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.676 178.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 51.8 m -60.85 -32.53 71.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.87 74.18 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.323 -1.308 . . . . 0.0 113.264 173.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.882 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.1 tt -61.78 -44.05 97.63 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 118.42 1.11 . . . . 0.0 108.314 175.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 937' ' ' ILE . 43.4 t -55.79 -44.1 76.26 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.1 mmpt? -61.58 -38.21 86.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.82 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.55 -25.58 38.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.893 -177.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.674 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.1 p -80.28 -15.58 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 C-N-CA 119.726 -0.789 . . . . 0.0 109.057 170.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 933' ' ' VAL . 20.5 mm -71.46 -35.37 56.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 166.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.633 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 70.4 mm-40 -52.85 -42.4 65.18 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.824 169.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.565 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 35.7 ttp -57.65 -46.69 83.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.485 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.582 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.4 p -72.75 -26.75 61.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.914 0.388 . . . . 0.0 110.979 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.457 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.2 m -78.82 -43.34 25.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.67 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.7 mmtp -54.58 -49.66 69.86 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.209 -1.814 . . . . 0.0 111.193 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.846 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.6 tt -65.57 -28.69 44.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 123.137 0.273 . . . . 0.0 111.599 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.793 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 26.4 mt-30 -50.06 -61.11 4.02 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 64.1 Cg_endo -97.78 16.73 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.562 1.508 . . . . 0.0 113.821 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.83 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -100.86 148.58 35.24 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -173.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 79.6 Cg_endo -86.4 -178.68 2.82 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.433 2.755 . . . . 0.0 110.231 165.211 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.864 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 10.0 Cg_endo -51.62 -34.63 53.78 Favored 'Trans proline' 0 C--O 1.249 1.057 0 C-N-CA 122.648 2.232 . . . . 0.0 112.73 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.534 ' O ' ' HD2' ' A' ' 953' ' ' PRO . 25.0 mt-10 -54.0 -39.05 65.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.018 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.83 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -95.83 2.42 53.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.864 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 21.0 m-30 -65.7 -38.56 89.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 172.22 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.983 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.34 -55.47 6.05 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 119.536 -0.866 . . . . 0.0 111.511 174.117 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.983 ' HD3' HG13 ' A' ' 952' ' ' VAL . 75.2 Cg_exo -51.02 -32.07 37.29 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 122.124 1.883 . . . . 0.0 115.166 173.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.846 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.9 ptt? -65.93 -45.18 82.8 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 121.502 -0.749 . . . . 0.0 110.157 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.698 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.8 t -69.94 -25.52 28.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.202 0.525 . . . . 0.0 110.022 173.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 61.0 tttm -61.2 -37.93 84.75 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.7 mm-40 -54.23 -44.61 71.87 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.494 172.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.7 t -65.57 -28.64 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.497 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.596 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.72 -43.45 51.32 Favored Glycine 0 C--N 1.328 0.131 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.561 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.4 mm? -62.74 -32.28 73.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 172.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.882 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -54.3 -56.13 21.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.012 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.785 HD11 HD13 ' A' ' 991' ' ' LEU . 61.1 tp -66.53 -36.47 82.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -58.11 -49.68 76.11 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.741 -0.599 . . . . 0.0 110.71 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 26.8 m -53.69 -35.78 61.47 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.124 173.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.717 HD11 ' HB2' ' A' ' 932' ' ' LEU . 7.2 mt -66.02 -38.03 87.41 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 120.847 0.356 . . . . 0.0 110.134 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.17 -32.65 37.04 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.203 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.41 -47.63 63.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.462 HG22 ' O ' ' A' ' 965' ' ' LEU . 6.8 t -69.56 -32.35 71.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.314 0.578 . . . . 0.0 110.109 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.923 HG13 HD11 ' A' ' 984' ' ' ILE . 45.5 t -55.5 -32.5 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.126 169.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.736 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 27.6 t70 -71.08 -25.38 62.6 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 120.636 0.255 . . . . 0.0 110.875 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 975' ' ' VAL . 5.4 mm-40 -65.52 -49.69 68.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.984 1.373 . . . . 0.0 108.408 169.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.587 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.2 t -65.87 -24.28 66.83 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 113.834 -1.53 . . . . 0.0 111.766 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.708 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.2 OUTLIER -61.58 -53.21 63.61 Favored Pre-proline 0 C--O 1.215 -0.761 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.791 -176.496 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 6.9 Cg_endo -54.77 -28.44 57.48 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 121.497 1.57 . . . . 0.0 111.584 168.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.71 -11.59 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.881 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.914 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -67.58 -51.97 29.2 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-O 118.965 -0.541 . . . . 0.0 111.316 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.578 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 32.5 Cg_exo -60.83 -33.01 93.37 Favored 'Trans proline' 0 C--N 1.363 1.297 0 C-N-CA 121.503 1.468 . . . . 0.0 110.715 173.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -60.13 -54.89 40.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.873 175.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.864 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -168.74 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.78 HG22 ' HB ' ' A' ' 984' ' ' ILE . 17.4 m -52.46 -20.2 2.72 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -170.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.914 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 19.1 p-80 -49.66 -22.19 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -171.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.24 -54.78 11.3 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.299 178.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.885 ' HB3' HG22 ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.14 -41.82 40.3 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 179.372 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.923 HD11 HG13 ' A' ' 969' ' ' VAL . 10.8 tp -60.87 -30.6 47.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.395 -171.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.87 -42.82 60.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.173 174.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.596 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 18.1 ptp -64.34 -52.83 56.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -173.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.839 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -75.94 -35.57 59.66 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.61 -174.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.573 ' NE2' HG13 ' A' ' 984' ' ' ILE . 32.9 mt-30 -57.97 -54.98 40.83 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.815 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -57.89 -36.6 72.64 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.802 0.81 . . . . 0.0 109.454 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.616 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 14.0 tp -60.63 -62.06 2.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.963 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.995 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 1.3 pp -73.1 -23.23 60.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -172.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.501 ' N ' HD12 ' A' ' 991' ' ' LEU . 24.2 t-20 -64.69 -35.66 81.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 23.7 m -76.04 -36.83 58.93 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.886 -178.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.05 -32.77 13.66 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.323 -171.409 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.025 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.7 tm? -58.46 -38.0 76.62 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.469 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -67.72 -41.17 83.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.482 ' HA ' ' OD1' ' A' 1000 ' ' ASN . 6.9 mm-40 -53.61 -44.3 69.34 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.3 172.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.572 ' HB3' ' CG1' ' A' ' 955' ' ' VAL . 4.2 mm? -69.56 -29.31 66.84 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.981 178.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.722 ' O ' ' HG2' ' A' 1002 ' ' MET . 43.8 mt -61.14 -45.5 98.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 174.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.586 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.3 OUTLIER -82.91 -15.26 52.1 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.985 -0.447 . . . . 0.0 111.292 178.472 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.62 ' HA ' ' CB ' ' A' 1004 ' ' LEU . 66.1 mttm -86.37 -26.58 24.74 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.478 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.869 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 21.1 ptt? -73.93 -34.24 64.26 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.922 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.6 ttpt -73.91 -18.03 60.96 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 113.324 -1.762 . . . . 0.0 109.573 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.62 ' CB ' ' HA ' ' A' 1001 ' ' LYS . 35.9 tp -85.84 -54.72 4.34 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.178 0.924 . . . . 0.0 110.646 -173.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.22 -38.62 83.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.263 0.554 . . . . 0.0 109.848 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -23.92 54.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.059 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.922 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.9 tp-100 -69.89 -42.16 73.79 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.355 0.598 . . . . 0.0 109.75 177.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.483 177.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? . . . . . 0 C--O 1.233 0.23 0 CA-C-O 120.492 0.187 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.5 -37.06 74.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.561 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -50.09 -39.84 43.74 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.775 0.321 . . . . 0.0 111.673 173.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 5.6 m-30 -84.89 -24.0 28.68 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.831 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.494 ' HB2' HE22 ' A' 1014 ' ' GLN . 76.1 tttt -69.74 -44.47 70.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.826 0.346 . . . . 0.0 110.401 174.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -57.95 -57.47 12.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.475 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -57.04 -37.21 71.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.71 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.474 ' HE2' ' HA ' ' A' 1018 ' ' LYS . 40.5 ttp -64.73 -42.15 95.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.802 0.335 . . . . 0.0 110.934 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.1 tp -66.06 -41.7 90.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.943 0.402 . . . . 0.0 110.72 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 4.5 m -65.42 -30.08 70.85 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.856 0.836 . . . . 0.0 109.99 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.442 ' C ' HD21 ' A' ' 998' ' ' LEU . . . -78.91 -40.08 33.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.695 -1.138 . . . . 0.0 109.91 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.518 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.63 ' O ' HG23 ' A' 1030 ' ' VAL . 15.2 t-80 -65.13 -38.22 89.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.81 -46.79 74.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.209 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.025 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.87 -32.58 73.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 109.988 179.566 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.626 ' N ' HD23 ' A' 1028 ' ' LEU . . . -60.52 -33.96 73.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.475 170.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' 1026 ' ' HIS . 85.9 t -75.82 -32.45 23.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 109.828 177.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.995 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 7.5 m-20 -59.34 -44.43 92.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.237 172.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.591 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -58.2 -52.97 63.34 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.793 170.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 1.6 tmtp? -53.47 -38.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.276 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.611 ' O ' HG23 ' A' 1038 ' ' VAL . 66.5 t30 -71.88 -39.89 69.31 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.911 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.793 HD22 HD21 ' A' ' 991' ' ' LEU . 17.1 tp -74.23 -29.52 61.74 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 121.279 -0.168 . . . . 0.0 110.657 -176.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.641 ' HB3' ' CG1' ' A' ' 929' ' ' VAL . 4.7 pp -70.5 -26.66 63.7 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.35 -39.68 38.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 174.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.885 HG22 ' HB3' ' A' ' 983' ' ' GLU . 19.5 t -51.77 -56.15 6.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.163 174.121 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.722 HG13 ' HB ' ' A' ' 925' ' ' VAL . 20.5 pt -94.24 -26.48 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -170.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.632 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 2.8 t0 -55.25 -42.63 73.72 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.511 162.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.673 ' O ' ' HG2' ' A' 1045 ' ' LYS . 21.8 mt-30 -77.61 -22.67 50.45 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.676 175.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.52 -50.79 64.69 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.055 0.455 . . . . 0.0 110.463 169.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.688 ' HG2' HG21 ' A' ' 925' ' ' VAL . 16.8 mmt180 -54.73 -38.12 66.74 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.093 0.473 . . . . 0.0 110.434 172.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.814 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 56.9 tp -69.48 -28.39 66.04 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.286 174.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.864 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 24.5 mmtp -67.84 -40.9 83.66 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.861 0.839 . . . . 0.0 109.133 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 26.6 ttt -59.23 -46.44 88.47 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.161 -1.381 . . . . 0.0 108.889 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.9 -50.8 78.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.011 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.1 m -41.84 -47.96 4.28 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.3 tt0 . . . . . 0 C--N 1.327 -0.409 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.744 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.72 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 8.4 tpt180 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.408 ' HB3' ' O ' ' A' ' 920' ' ' ARG . 22.7 t 76.88 26.96 0.75 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.393 0.616 . . . . 0.0 110.054 -173.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 46.93 69.79 0.46 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.706 168.635 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.5 t70 -47.05 -174.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.648 -1.615 . . . . 0.0 112.67 -178.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.402 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 1.2 tmtp? -40.12 -23.05 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.998 0.919 . . . . 0.0 112.169 -177.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.672 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 7.5 m -56.36 -50.28 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 172.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.506 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 7.6 t80 -75.08 -29.75 60.76 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.011 0.91 . . . . 0.0 108.8 -176.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.37 -56.22 9.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.615 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.423 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.81 -38.75 76.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.677 -175.636 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.936 ' HB ' HD11 ' A' 1039 ' ' ILE . 9.5 p -60.41 -34.13 56.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.904 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 93.4 m -69.1 -35.66 76.71 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.47 -28.03 61.7 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.618 174.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.916 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.1 tt -66.83 -46.8 73.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 937' ' ' ILE . 17.7 t -59.59 -39.85 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.165 176.496 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.666 ' O ' HG12 ' A' ' 937' ' ' ILE . 10.0 mmpt? -70.3 -19.03 63.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.102 0.477 . . . . 0.0 110.435 177.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.728 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.63 -25.33 33.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.92 0.39 . . . . 0.0 110.623 175.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.587 ' O ' ' HB3' ' A' ' 939' ' ' MET . 11.1 p -86.41 -10.09 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.927 172.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 934' ' ' LYS . 5.6 pt -83.48 -27.24 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 165.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.3 mt-10 -57.64 -39.29 76.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 164.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.613 ' HG2' ' SD ' ' A' ' 954' ' ' MET . 1.7 tmt? -57.07 -45.6 83.13 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.054 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 21.0 m -67.65 -30.06 69.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.99 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.1 m -79.62 -46.67 16.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.995 0.902 . . . . 0.0 108.677 -175.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.56 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 3.3 tmtm? -56.86 -45.61 82.35 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.366 -1.743 . . . . 0.0 110.786 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.1 tt -67.69 -30.34 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 O-C-N 123.302 0.376 . . . . 0.0 111.772 -176.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.803 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.4 mt-30 -50.09 -60.01 5.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.762 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 77.5 Cg_endo -97.37 34.8 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.513 1.475 . . . . 0.0 112.935 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -120.43 141.37 31.88 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 86.7 Cg_endo -88.7 -179.33 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 123.19 2.593 . . . . 0.0 109.718 165.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.638 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 9.1 Cg_endo -50.87 -32.37 37.24 Favored 'Trans proline' 0 C--O 1.247 0.932 0 C-N-CA 122.5 2.134 . . . . 0.0 112.451 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.6 -43.7 72.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.962 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.675 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.8 mp0 -95.71 1.72 53.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.537 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.638 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 5.9 m-30 -61.01 -48.25 82.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.519 -0.473 . . . . 0.0 109.786 176.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.027 HG13 ' HD3' ' A' ' 953' ' ' PRO . 1.3 p -75.72 -42.71 3.86 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.294 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.027 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.5 Cg_exo -52.68 -30.69 47.08 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.459 2.106 . . . . 0.0 113.753 168.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 33.8 ttp -56.88 -54.13 50.03 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 122.119 0.962 . . . . 0.0 109.189 174.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.537 HG11 ' HA ' ' A' ' 999' ' ' ILE . 42.0 t -60.64 -28.17 42.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.33 172.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 82.0 tttt -59.37 -38.28 80.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.485 ' OE1' ' HB3' ' A' ' 938' ' ' GLU . 38.9 mt-10 -59.11 -46.0 89.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.248 176.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.841 HG21 HD21 ' A' 1028 ' ' LEU . 10.0 p -75.11 -22.08 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 120.116 -0.633 . . . . 0.0 111.416 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.424 ' HA2' ' CD1' ' A' ' 995' ' ' LEU . . . -71.89 -43.83 48.72 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.646 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.78 -23.69 65.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.025 0.44 . . . . 0.0 110.732 172.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.42 -55.67 30.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.846 175.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.548 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 35.0 tp -64.37 -35.02 79.52 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.165 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 10.2 tpt180 -55.07 -57.73 10.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.187 0.518 . . . . 0.0 111.195 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 12.7 m -57.34 -38.14 73.65 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 110.646 175.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.799 HD21 HD23 ' A' 1035 ' ' LEU . 56.1 tp -64.64 -28.07 69.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.069 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.447 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 54.2 tp -62.29 -33.19 74.18 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.69 93.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.198 0.523 . . . . 0.0 110.034 172.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.672 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.8 m -67.59 -37.91 83.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.882 173.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 965' ' ' LEU . 93.8 t -56.47 -30.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.204 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.606 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.4 t70 -77.64 -22.29 50.93 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.429 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.633 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 41.8 mm-40 -71.82 -50.41 29.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 122.718 1.247 . . . . 0.0 108.499 170.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.635 ' OG ' HG21 ' A' ' 980' ' ' THR . 47.8 t -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.685 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.757 ' HA ' HD23 ' A' ' 976' ' ' LEU . 7.4 tt -60.87 -54.39 54.86 Favored Pre-proline 0 C--O 1.213 -0.827 0 CA-C-O 118.445 -0.788 . . . . 0.0 112.156 -176.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 38.0 Cg_exo -59.5 -27.49 85.09 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 121.613 1.612 . . . . 0.0 110.486 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.1 t -75.72 -14.2 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.982 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.954 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.6 pp -76.81 -41.98 2.77 Favored Pre-proline 0 CA--C 1.539 0.529 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.762 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.954 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 17.2 Cg_exo -69.03 -28.98 28.09 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.068 1.417 . . . . 0.0 110.118 172.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.32 -55.75 28.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.23 171.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.838 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 38.6 m -162.7 -42.04 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.833 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 93.6 m -51.53 -26.99 9.52 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -171.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.721 ' HA ' HG22 ' A' ' 984' ' ' ILE . 11.6 p80 -50.97 -39.12 54.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.1 0.864 . . . . 0.0 112.723 -165.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.4 mtm180 -53.73 -50.85 65.04 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.537 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.831 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.7 -48.35 32.73 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.841 -178.611 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.721 HG22 ' HA ' ' A' ' 981' ' ' HIS . 9.7 tp -60.4 -30.2 45.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.162 -174.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.65 -35.86 75.57 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.027 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.669 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 15.6 ptm -66.78 -52.69 41.12 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.455 -176.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.711 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -80.41 -44.75 18.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -174.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.474 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -64.24 -35.29 80.32 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.033 -173.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -66.11 -42.49 89.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.415 0.626 . . . . 0.0 109.515 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -49.56 75.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.261 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.645 HD21 HD22 ' A' 1035 ' ' LEU . 2.4 pp -73.92 -29.39 62.02 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -173.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.524 ' N ' HD12 ' A' ' 991' ' ' LEU . 6.8 t30 -57.81 -43.34 85.65 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 m -76.6 -25.21 53.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.92 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -101.29 -45.56 5.3 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -172.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.935 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.31 -52.7 62.6 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.334 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.53 -43.99 80.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.517 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' 1001 ' ' LYS . 62.1 tt0 -54.23 -41.06 68.27 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.548 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.647 HD12 ' HB3' ' A' 1001 ' ' LYS . 46.0 tp -70.05 -31.22 68.73 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.693 -175.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' 1003 ' ' LYS . 59.3 mt -58.96 -35.05 54.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.332 0.586 . . . . 0.0 109.862 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.452 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 35.5 m-80 -95.66 -10.16 30.12 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.771 178.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.647 ' HB3' HD12 ' A' ' 998' ' ' LEU . 27.1 tptt -82.75 -48.4 10.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.594 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 7.8 tpt -79.58 -26.39 41.32 Favored 'General case' 0 N--CA 1.438 -1.037 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.223 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.715 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.5 tttm -56.16 -48.96 75.31 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 168.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.449 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 31.7 tp -58.31 -43.73 88.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.351 174.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -64.16 -42.08 96.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.05 0.452 . . . . 0.0 110.926 178.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.54 -12.54 60.04 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.218 177.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.715 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.1 tp60 -85.09 -23.27 28.57 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.563 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.479 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.042 176.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.461 0.103 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -60.3 -37.4 80.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.809 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' 1020 ' ' GLN . 15.0 tp10 -50.78 -50.38 56.19 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.673 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.479 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.32 -25.57 61.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.792 0.33 . . . . 0.0 111.445 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' 1021 ' ' MET . 62.1 tttm -70.2 -36.04 74.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.319 0.581 . . . . 0.0 109.848 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 78.2 tttt -65.82 -29.75 70.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.267 174.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' 1016 ' ' GLU . 79.1 mt-30 -83.84 -38.33 21.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.992 -176.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -71.59 -25.94 62.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.854 177.611 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.9 tm? -64.82 -42.18 95.17 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 16.7 m -58.91 -35.55 73.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.452 176.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' 1001 ' ' LYS . . . -79.06 -38.82 35.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.441 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -61.69 -32.65 72.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.098 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.512 ' O ' HG23 ' A' 1030 ' ' VAL . 77.9 t60 -72.9 -40.89 65.18 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.151 176.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.28 -37.6 87.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.204 0.526 . . . . 0.0 109.851 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.935 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -60.2 -50.33 74.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.583 173.568 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.11 70.38 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.374 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' 1026 ' ' HIS . 97.5 t -65.75 -33.15 61.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.689 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.81 -39.32 73.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.857 -0.737 . . . . 0.0 109.948 -177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.793 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.15 -53.69 51.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.54 170.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.813 ' HA ' HD23 ' A' 1036 ' ' LEU . 96.9 mttt -63.77 -32.47 73.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -175.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' 1038 ' ' VAL . 13.2 t-20 -69.79 -36.88 76.07 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.006 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.799 HD23 HD21 ' A' ' 965' ' ' LEU . 13.6 tp -77.65 -24.17 49.51 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.486 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.891 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.5 OUTLIER -59.42 -43.76 93.0 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' 1041 ' ' GLN . 33.6 t70 -73.94 -22.6 59.6 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.217 177.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.831 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 15.1 t -76.89 -46.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.855 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.936 HD11 ' HB ' ' A' ' 929' ' ' VAL . 8.0 pt -92.62 -31.69 4.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -175.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.578 ' HB3' ' O ' ' A' 1036 ' ' LEU . 0.5 OUTLIER -54.1 -48.43 70.71 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 163.936 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.645 ' HG2' HD12 ' A' 1044 ' ' LEU . 88.5 mt-30 -75.37 -22.33 57.6 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 115.063 -0.972 . . . . 0.0 111.201 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.712 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.4 -52.75 62.53 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.382 0.611 . . . . 0.0 110.255 165.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.748 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 1.2 mpt_? -59.39 -28.26 66.73 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.74 173.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.645 HD12 ' HG2' ' A' 1041 ' ' GLN . 84.0 mt -78.76 -23.37 45.38 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.108 173.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.838 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 48.6 mmtm -63.28 -36.21 82.93 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 2.0 tmt? -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.268 176.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.5 -38.93 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.685 172.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.7 m -64.53 -41.45 96.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.601 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 60.7 tp60 . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.057 -178.691 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB2' HG13 ' A' 1047 ' ' ILE . 3.8 tpt180 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 29.9 m -85.49 27.62 0.82 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.629 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.61 68.76 0.78 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.862 0.865 . . . . 0.0 112.148 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.747 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.3 t70 -47.68 -171.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.497 -2.138 . . . . 0.0 112.511 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.0 tmtm? -27.92 -26.9 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.16 1.384 . . . . 0.0 113.8 177.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.846 HG21 ' HB2' ' A' 1043 ' ' ARG . 3.9 m -57.33 -52.65 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 174.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -77.28 -26.21 52.15 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 34.0 mt-10 -66.79 -62.28 1.53 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.761 -1.108 . . . . 0.0 112.097 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.483 ' HB2' ' CD ' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.91 -32.53 67.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.788 -0.187 . . . . 0.0 111.141 -172.452 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.952 HG11 ' HA ' ' A' 1036 ' ' LEU . 10.7 p -61.38 -31.76 51.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.888 175.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.574 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.6 m -63.46 -38.08 89.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 169.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 931' ' ' GLY . . . . . 0.455 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -59.09 -27.63 62.78 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.865 173.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.953 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 15.7 tp -66.03 -34.35 77.88 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.607 ' O ' HG12 ' A' ' 937' ' ' ILE . 57.7 t -77.01 -37.7 26.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.293 173.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.5 mmpt? -58.85 -37.57 76.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.155 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 1.116 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.1 -24.64 40.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.708 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.589 HG12 ' HA ' ' A' ' 933' ' ' VAL . 14.5 p -79.47 -15.33 13.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.045 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 933' ' ' VAL . 44.1 mm -74.62 -38.53 45.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 165.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.655 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 19.2 mm-40 -52.45 -46.28 66.39 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 167.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.607 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 29.3 ttp -58.32 -37.0 74.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.667 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.59 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 46.1 m -74.29 -37.96 63.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.625 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.503 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 28.3 m -78.82 -44.27 23.43 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.979 0.895 . . . . 0.0 109.452 -175.538 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.717 ' HD2' ' HB2' ' A' ' 954' ' ' MET . 4.5 tmtm? -59.89 -34.75 73.58 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.383 -178.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.553 HD12 ' HE1' ' A' ' 954' ' ' MET . 7.6 tt -77.35 -24.99 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 O-C-N 123.0 0.187 . . . . 0.0 111.143 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.743 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 87.1 mm-40 -51.39 -55.65 27.18 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.575 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.743 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.8 Cg_endo -99.89 31.59 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.148 1.899 . . . . 0.0 112.697 175.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -102.87 126.27 33.09 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -172.46 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.412 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 67.7 Cg_endo -77.26 171.88 17.0 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.75 2.3 . . . . 0.0 109.298 160.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.569 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 6.3 Cg_endo -50.01 -38.71 49.76 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 122.581 2.188 . . . . 0.0 112.689 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.06 -23.95 65.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.668 ' HB3' ' HE3' ' A' ' 942' ' ' LYS . 20.4 mm-40 -102.39 -15.66 16.46 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.327 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB2' ' HG3' ' A' 1006 ' ' GLN . 26.8 m-85 -55.03 -51.44 66.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.295 0.569 . . . . 0.0 109.644 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -66.91 -42.75 44.69 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.728 -178.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 73.8 Cg_exo -58.26 -35.1 99.04 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 121.639 1.559 . . . . 0.0 113.555 168.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.717 ' HB2' ' HD2' ' A' ' 942' ' ' LYS . 0.3 OUTLIER -62.44 -50.19 72.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.865 0.84 . . . . 0.0 109.737 177.492 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.615 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -60.41 -26.32 36.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.22 172.516 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 2.6 ttpm? -66.37 -35.16 79.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.8 mm-40 -56.51 -46.73 80.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.049 178.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.568 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 12.2 p -69.71 -22.64 25.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.957 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.417 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -69.24 -43.31 71.7 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.116 -1.04 . . . . 0.0 111.507 175.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.83 -22.2 65.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 111.067 172.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 1.116 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -63.47 -57.63 9.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.251 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 965' ' ' LEU . 16.9 tp -68.82 -32.55 72.33 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.495 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -57.48 -60.5 3.55 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.427 HG22 ' OD1' ' A' ' 928' ' ' ASN . 22.5 m -55.31 -34.8 64.48 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.848 0.832 . . . . 0.0 110.293 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 962' ' ' LEU . 2.6 tm? -64.52 -28.73 69.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.577 176.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 85.8 mt -67.5 -28.96 68.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.612 0.244 . . . . 0.0 110.654 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.56 -42.91 98.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.439 0.638 . . . . 0.0 109.497 172.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.783 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.8 m -62.36 -40.04 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.927 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.844 HG13 HD11 ' A' ' 984' ' ' ILE . 54.4 t -55.62 -31.26 28.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.197 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.563 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.0 t70 -74.46 -22.42 59.11 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.636 0.255 . . . . 0.0 110.97 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.63 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 59.6 mm-40 -71.95 -46.53 57.12 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 122.635 1.207 . . . . 0.0 109.317 169.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.438 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 28.5 t -66.32 -24.64 66.57 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.59 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.625 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.0 tp -60.57 -50.14 86.81 Favored Pre-proline 0 C--O 1.22 -0.498 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.248 -177.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.63 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.6 Cg_exo -58.12 -28.27 83.06 Favored 'Trans proline' 0 C--N 1.358 1.062 0 CA-C-N 121.02 1.4 . . . . 0.0 110.868 169.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.612 HG11 ' O ' ' A' 1042 ' ' ALA . 40.9 t -74.45 -15.76 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.547 176.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.767 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 2.2 tt -67.92 -52.72 23.24 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.157 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 35.8 Cg_exo -61.62 -29.07 83.52 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.155 1.237 . . . . 0.0 110.719 172.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -66.52 -59.39 3.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.392 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.557 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 68.8 m -163.9 -39.03 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -173.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 976' ' ' LEU . 2.0 t -62.11 -16.14 50.36 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -169.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.767 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 35.7 t60 -48.44 -21.55 0.57 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.806 0.443 . . . . 0.0 112.073 -177.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 11.1 tpp180 -77.66 -54.36 6.47 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.324 0.583 . . . . 0.0 110.379 176.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.887 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.65 -46.54 25.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.312 -176.022 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.844 HD11 HG13 ' A' ' 969' ' ' VAL . 12.6 tt -57.8 -32.96 44.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.228 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.58 -35.26 67.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.363 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.716 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.1 ptp -61.53 -61.5 2.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.746 -176.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.726 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.42 -34.94 31.24 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.504 ' NE2' HG11 ' A' ' 969' ' ' VAL . 45.2 tt0 -64.05 -47.76 78.91 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.59 0.632 . . . . 0.0 111.25 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -68.56 -27.9 66.48 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.529 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 7.3 tp -63.65 -42.99 98.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.857 176.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.726 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 92.6 mt -68.13 -31.29 70.78 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.035 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -56.4 -47.18 79.51 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -31.42 58.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.715 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.568 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.7 p30 -91.37 -52.09 4.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 120.069 -0.652 . . . . 0.0 112.435 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.039 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.05 -52.03 59.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.886 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.7 87.78 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.18 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 7.8 pt-20 -65.11 -32.6 74.38 Favored 'General case' 0 C--O 1.212 -0.909 0 C-N-CA 119.164 -1.015 . . . . 0.0 110.581 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.683 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 3.0 mm? -66.38 -41.86 88.77 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.647 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.506 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.3 mt -52.99 -40.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.981 173.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.508 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 51.3 m-20 -88.41 -10.07 50.49 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.343 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.683 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -85.77 -39.26 17.32 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.786 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.691 ' SD ' ' HD2' ' A' ' 951' ' ' TYR . 0.1 OUTLIER -78.72 -36.57 43.16 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 174.601 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.692 ' O ' ' HB2' ' A' 1007 ' ' GLN . 76.0 tttt -60.48 -52.48 65.02 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.139 173.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 13.7 mt -57.47 -41.17 80.11 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 174.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.796 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -61.62 -45.8 92.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 0.0 110.496 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.739 ' HG3' ' HB2' ' A' ' 951' ' ' TYR . 11.7 mm-40 -77.63 -9.55 59.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.733 0.778 . . . . 0.0 110.34 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.692 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.4 OUTLIER -87.55 -5.31 58.82 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.256 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 79.5 t80 . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.784 179.605 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -60.88 -37.73 83.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.482 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -49.88 -50.03 47.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 173.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.796 ' HD2' ' HA ' ' A' 1005 ' ' ALA . 1.1 m-30 -71.04 -28.15 64.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.559 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -74.86 -25.12 58.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.207 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 46.4 tttp -65.86 -61.0 2.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.173 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.03 -41.83 26.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.759 168.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.625 ' HG3' ' HE3' ' A' 1002 ' ' MET . 1.8 tmt? -63.42 -44.64 94.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.837 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 50.8 tp -60.5 -37.66 81.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.779 0.324 . . . . 0.0 111.42 -177.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 25.9 m -68.93 -31.77 70.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.573 0.702 . . . . 0.0 110.15 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.403 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -79.25 -39.26 33.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.86 -178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.455 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -63.84 -36.28 83.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.758 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 63.6 t60 -66.52 -31.16 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.493 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.94 -50.54 55.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.375 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.039 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.97 -32.07 73.07 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.15 0.5 . . . . 0.0 109.755 -175.335 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.63 ' N ' HD23 ' A' 1028 ' ' LEU . . . -61.69 -44.84 96.17 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.091 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 64.5 t -77.25 -18.99 14.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.547 ' C ' HD21 ' A' ' 991' ' ' LEU . 69.3 m-20 -85.73 -34.42 21.23 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.702 176.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.633 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -53.83 -49.14 69.06 Favored 'General case' 0 C--N 1.345 0.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 161.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.763 ' HA ' HD23 ' A' 1036 ' ' LEU . 56.8 tttm -61.14 -28.38 69.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.638 177.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.587 ' O ' HG23 ' A' 1038 ' ' VAL . 67.2 t30 -74.74 -34.32 62.5 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.9 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.705 ' CD2' HD11 ' A' ' 965' ' ' LEU . 25.1 tp -78.09 -23.69 47.86 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.688 -177.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.952 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.2 pp -63.6 -43.27 97.39 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.415 ' N ' HD12 ' A' 1036 ' ' LEU . 16.5 t70 -62.68 -43.73 98.05 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.101 175.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.887 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 44.2 t -53.4 -69.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.575 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.931 HD11 ' HB ' ' A' ' 929' ' ' VAL . 7.1 pt -77.94 -26.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.2 t70 -49.94 -48.21 52.05 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 163.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.424 ' O ' ' N ' ' A' 1045 ' ' LYS . 96.7 mt-30 -78.72 -24.54 44.87 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.192 177.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.719 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.88 -56.01 24.16 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 118.921 0.782 . . . . 0.0 111.537 171.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.846 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.0 OUTLIER -55.68 -30.38 60.97 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.564 176.194 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 41.6 tp -74.77 -37.27 62.49 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.591 172.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 13.6 mptt -53.68 -38.98 64.74 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.018 0.927 . . . . 0.0 109.869 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.8 ttt -60.54 -44.59 95.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.583 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 920' ' ' ARG . 43.3 mm -70.52 -28.7 35.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.448 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 67.8 m -58.9 -54.65 44.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.412 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.34 0.591 . . . . 0.0 110.114 178.812 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.871 ' HD3' ' HB2' ' A' 1044 ' ' LEU . 2.0 ttt-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 43.5 t 62.66 10.3 4.07 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 122.703 0.401 . . . . 0.0 111.695 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 46.02 52.74 9.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 123.364 0.666 . . . . 0.0 110.85 -176.146 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.485 ' O ' ' N ' ' A' ' 925' ' ' VAL . 9.4 t70 -45.58 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 125.817 1.948 . . . . 0.0 112.182 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.6 tmtp? -44.82 -14.18 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.515 0.726 . . . . 0.0 111.722 -178.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.833 ' HA ' HG23 ' A' ' 968' ' ' THR . 9.8 m -63.15 -53.3 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.15 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.573 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 59.2 t80 -77.62 -28.35 51.43 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.661 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.6 mt-10 -62.71 -66.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.175 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.525 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.5 t30 -66.71 -36.17 81.85 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.264 -172.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.861 ' HA ' HD13 ' A' ' 932' ' ' LEU . 9.9 p -61.66 -39.48 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 120.932 0.396 . . . . 0.0 111.339 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.564 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 59.9 m -66.24 -33.36 75.57 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.26 -30.04 60.76 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 114.55 -1.204 . . . . 0.0 112.757 172.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 1.041 HD11 ' HB2' ' A' ' 965' ' ' LEU . 6.9 mp -63.04 -45.85 90.33 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 117.941 0.871 . . . . 0.0 109.622 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 936' ' ' VAL . 61.8 t -63.21 -37.34 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.648 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -68.4 -31.57 71.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.209 0.528 . . . . 0.0 110.373 175.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -77.56 -25.32 49.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.563 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -81.3 -6.71 10.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 119.714 -0.794 . . . . 0.0 109.34 172.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.564 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 66.1 mt -75.91 -33.75 26.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 165.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 24.6 mm-40 -53.24 -40.7 64.79 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.66 168.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.918 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.5 tmm? -58.12 -46.9 84.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.941 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.601 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 46.9 m -64.08 -33.08 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.201 179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.716 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 13.3 m -77.46 -45.49 25.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.953 0.882 . . . . 0.0 108.938 -176.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.554 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 8.5 mmtp -55.94 -47.1 78.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.063 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.615 ' HA ' ' OE1' ' A' ' 950' ' ' GLU . 10.9 tt -68.89 -28.89 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.515 -174.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.625 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 75.8 mt-30 -53.28 -62.03 4.12 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.716 ' HD3' ' O ' ' A' ' 941' ' ' SER . 5.7 Cg_exo -77.64 -35.69 1.44 Allowed 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.703 1.602 . . . . 0.0 114.88 -170.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.441 ' HB3' ' CG ' ' A' ' 950' ' ' GLU . . . -105.92 164.21 15.47 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -167.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.642 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 10.8 Cg_exo -74.26 179.99 5.29 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 123.845 3.03 . . . . 0.0 110.94 169.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.69 -15.56 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 124.134 3.223 . . . . 0.0 115.323 -171.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 7.0 pt-20 -57.72 -20.07 31.91 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.395 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.642 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.2 OUTLIER -87.78 -22.01 24.78 Favored 'General case' 0 CA--C 1.511 -0.524 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.659 174.288 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.712 ' HD2' ' HA ' ' A' 1002 ' ' MET . 0.3 OUTLIER -56.22 -50.47 71.18 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 123.814 0.697 . . . . 0.0 110.245 -172.246 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.993 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -75.11 -45.04 4.74 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.635 178.574 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.993 ' HD3' HG13 ' A' ' 952' ' ' VAL . 85.4 Cg_exo -56.74 -27.49 71.3 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 121.599 1.532 . . . . 0.0 114.731 172.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.918 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 26.4 ptt? -74.61 -35.68 62.94 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.758 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 1.053 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -63.21 -27.49 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.473 170.543 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.72 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.7 ttpp -56.07 -41.73 75.55 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.1 mm-40 -58.26 -46.25 86.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.36 -1.291 . . . . 0.0 111.558 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.563 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.3 m -74.36 -28.46 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.8 -42.35 38.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.048 -1.073 . . . . 0.0 111.861 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 57.2 tp -58.61 -34.52 71.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.244 0.545 . . . . 0.0 109.595 171.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.61 -48.42 81.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.736 174.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 17.9 tp -68.7 -36.85 78.99 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.726 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 46.6 ttp180 -63.77 -47.9 79.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.605 -0.684 . . . . 0.0 111.595 176.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 p -56.81 -35.7 69.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.318 0.58 . . . . 0.0 109.869 171.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 1.041 ' HB2' HD11 ' A' ' 932' ' ' LEU . 63.7 tp -64.41 -34.51 78.34 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.84 176.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 88.5 mt -58.25 -33.82 69.79 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.099 178.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.4 -43.06 91.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.63 0.728 . . . . 0.0 109.647 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.833 HG23 ' HA ' ' A' ' 925' ' ' VAL . 6.2 m -60.29 -43.4 96.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.861 173.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.568 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 76.3 t -55.3 -35.99 38.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.905 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.654 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 16.2 t70 -71.63 -22.33 61.71 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 120.504 0.193 . . . . 0.0 111.447 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 975' ' ' VAL . 7.2 mm-40 -70.06 -47.87 60.18 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 122.838 1.304 . . . . 0.0 108.379 170.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.625 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.7 t -67.83 -25.44 65.56 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.657 -1.611 . . . . 0.0 111.67 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.631 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.6 mt -63.16 -51.34 70.38 Favored Pre-proline 0 C--O 1.218 -0.579 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.654 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.6 Cg_endo -57.48 -29.42 84.64 Favored 'Trans proline' 0 C--N 1.352 0.762 0 CA-C-N 121.594 1.605 . . . . 0.0 110.729 169.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' 1042 ' ' ALA . 2.5 t -76.76 -11.29 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 119.899 -0.721 . . . . 0.0 110.885 175.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.631 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.2 tt -65.19 -56.08 22.22 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.796 176.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 976' ' ' LEU . 31.5 Cg_exo -60.5 -31.99 93.11 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 121.297 1.331 . . . . 0.0 110.628 174.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.05 -53.06 61.82 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.315 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.779 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.3 m -169.33 -38.32 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.699 HG22 ' HB ' ' A' ' 984' ' ' ILE . 5.5 m -57.04 -17.42 10.07 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.593 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 13.7 p-80 -48.6 -18.84 0.28 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -77.62 -54.89 5.85 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.059 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.056 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.8 OUTLIER -79.84 -44.21 20.93 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.315 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.699 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -59.25 -33.33 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -173.67 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.37 -36.05 68.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.661 174.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptm -67.34 -56.24 10.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.78 -176.011 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.576 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.66 -39.94 23.61 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 1.071 ' HA ' HD12 ' A' ' 991' ' ' LEU . 25.0 tm0? -67.47 -38.99 85.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.688 -173.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -72.5 -24.67 61.19 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.479 0.657 . . . . 0.0 109.268 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.4 tp -72.79 -41.13 65.3 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.561 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.071 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.5 mt -59.01 -50.51 73.82 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.216 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.42 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 27.9 t-20 -55.5 -38.83 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.818 -178.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -67.51 -38.77 84.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.408 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.703 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -113.31 -30.13 7.01 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -170.669 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.082 ' HA ' HD12 ' A' 1028 ' ' LEU . 4.2 mm? -55.95 -51.16 68.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 166.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.767 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -60.65 -44.33 96.54 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.582 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.597 ' HG3' ' HE2' ' A' 1001 ' ' LYS . 6.3 tp10 -51.97 -42.93 63.29 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.983 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.695 ' O ' ' HG2' ' A' 1002 ' ' MET . 3.8 mm? -70.94 -33.1 70.17 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.568 -175.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.777 ' HA ' HG11 ' A' ' 955' ' ' VAL . 8.2 pt -62.65 -23.57 33.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.095 177.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.745 ' O ' ' HB2' ' A' 1004 ' ' LEU . 17.0 m-80 -94.52 -10.3 32.64 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.262 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.597 ' HE2' ' HG3' ' A' ' 997' ' ' GLU . 73.0 mmtt -83.36 -40.14 19.81 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.053 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 8.6 mmt -70.81 -44.2 67.06 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.732 ' O ' ' HB2' ' A' 1007 ' ' GLN . 86.2 tttt -57.62 -45.69 85.07 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.464 173.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.745 ' HB2' ' O ' ' A' 1000 ' ' ASN . 17.0 tp -55.09 -53.53 54.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.454 0.702 . . . . 0.0 112.824 172.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.25 -41.74 93.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.077 0.465 . . . . 0.0 110.58 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.06 -18.05 59.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.555 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.732 ' HB2' ' O ' ' A' 1003 ' ' LYS . 28.6 tp60 -75.94 -41.03 52.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.362 178.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.59 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.354 176.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.574 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? . . . . . 0 CA--C 1.523 -0.065 0 CA-C-O 120.795 0.331 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.577 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 14.5 mp0 -61.7 -33.37 73.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.765 -176.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.73 -47.75 50.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.682 0.277 . . . . 0.0 111.232 169.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.625 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.9 m-30 -76.12 -22.09 55.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.195 0.521 . . . . 0.0 110.508 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.685 ' HG3' ' OH ' ' A' ' 951' ' ' TYR . 75.7 tttt -73.03 -41.81 63.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.164 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.84 -18.64 61.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.962 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -77.24 -40.57 44.33 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' SD ' ' A' 1002 ' ' MET . 1.5 tmt? -66.04 -38.83 89.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.869 174.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 7.6 tt -55.38 -50.8 68.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.895 0.379 . . . . 0.0 110.405 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 13.1 m -67.62 -34.64 77.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.486 0.66 . . . . 0.0 110.808 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -74.36 -37.49 63.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.097 -176.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -66.26 -32.04 73.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.649 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' 1030 ' ' VAL . 12.0 t-80 -66.67 -32.49 73.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.4 -50.97 57.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.923 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.082 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -67.4 -30.7 70.53 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.261 0.553 . . . . 0.0 110.304 -178.168 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.647 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.52 -41.41 76.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.853 170.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' 1026 ' ' HIS . 88.8 t -66.67 -31.12 52.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.649 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.703 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 5.8 m-20 -59.07 -47.48 85.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.046 0.45 . . . . 0.0 109.961 176.027 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.12 87.19 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.567 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.759 ' O ' ' HG ' ' A' 1036 ' ' LEU . 31.0 mmmt -63.31 -36.63 84.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.123 0.487 . . . . 0.0 111.358 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' 1038 ' ' VAL . 4.4 t-20 -68.71 -39.67 80.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.381 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 991' ' ' LEU . 12.1 tp -78.86 -22.23 46.35 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.866 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.778 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -67.95 -31.59 71.44 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' 1041 ' ' GLN . 28.3 t70 -75.89 -31.89 59.41 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.512 171.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.056 HG13 ' HB3' ' A' ' 983' ' ' GLU . 33.9 t -64.04 -67.31 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.297 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.749 HG12 ' O ' ' A' 1035 ' ' LEU . 7.7 pt -80.99 -32.23 12.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.061 -170.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.573 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 12.6 t0 -55.11 -45.93 75.52 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 166.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.65 ' HB2' ' O ' ' A' 1037 ' ' ASP . 2.7 mp0 -67.86 -28.65 67.72 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.147 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.63 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -52.81 -53.18 52.13 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-O 120.861 0.362 . . . . 0.0 111.063 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.453 ' HB3' ' HG3' ' A' ' 920' ' ' ARG . 0.9 OUTLIER -54.21 -36.6 63.64 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.008 176.052 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.871 ' HB2' ' HD3' ' A' ' 920' ' ' ARG . 14.6 tp -76.81 -25.25 53.07 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.982 -0.449 . . . . 0.0 111.539 173.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.779 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 25.0 mmtp -63.21 -21.39 66.19 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 172.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' 1043 ' ' ARG . 11.9 tmm? -74.89 -43.91 51.77 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.728 -1.123 . . . . 0.0 108.913 176.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.499 ' HB ' HD12 ' A' 1044 ' ' LEU . 3.9 mp -61.31 -41.57 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 121.609 0.719 . . . . 0.0 109.868 170.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.519 ' HB2' ' HA ' ' A' 1045 ' ' LYS . 32.8 m -69.35 -12.73 61.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.093 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.391 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.564 ' HG3' ' HB3' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 120.964 0.411 . . . . 0.0 110.17 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 17.7 p -91.31 25.38 2.58 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.551 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.559 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.28 54.71 7.02 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.218 -175.553 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.48 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -47.01 -173.27 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 125.763 1.914 . . . . 0.0 112.084 -176.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.597 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.0 tmtm? -39.01 -22.74 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.385 0.674 . . . . 0.0 111.685 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 1.022 ' HA ' HG23 ' A' ' 968' ' ' THR . 14.8 m -56.64 -52.82 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.599 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.437 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 12.9 t80 -77.91 -32.99 52.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 930' ' ' THR . 3.3 tt0 -61.19 -58.57 7.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 113.208 -1.815 . . . . 0.0 112.102 -174.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -71.99 -32.27 67.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.59 -172.903 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.619 ' HA ' HD12 ' A' ' 965' ' ' LEU . 39.9 t -63.33 -35.09 70.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.092 173.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.533 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -65.33 -39.05 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 169.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.07 -29.75 62.85 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.935 175.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.82 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 22.5 tp -65.39 -38.79 91.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.479 ' HA ' HG12 ' A' ' 936' ' ' VAL . 38.2 t -67.66 -40.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.13 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -61.8 -30.6 70.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.159 0.504 . . . . 0.0 110.107 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.6 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -76.65 -26.33 54.72 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.354 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.0 p -85.04 -4.97 9.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.899 0.857 . . . . 0.0 109.092 172.135 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 62.4 mt -81.46 -38.63 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 163.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 73.0 mm-40 -52.77 -40.28 63.0 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.364 167.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.705 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.26 -44.93 92.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.839 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.619 ' O ' HG22 ' A' ' 943' ' ' ILE . 5.0 p -74.57 -27.36 60.46 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.4 p -79.13 -44.98 20.93 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.694 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 0.1 OUTLIER -51.35 -43.53 61.83 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 113.304 -1.771 . . . . 0.0 110.889 172.765 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 940' ' ' SER . 0.3 OUTLIER -67.54 -29.37 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 O-C-N 123.841 0.713 . . . . 0.0 110.746 -175.498 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.821 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.8 mm-40 -52.01 -58.58 10.81 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-O 119.398 -0.334 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.821 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 56.6 Cg_endo -101.25 26.22 0.13 Allowed 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 121.884 1.723 . . . . 0.0 113.166 175.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.694 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -83.86 121.87 76.1 Favored Pre-proline 0 C--N 1.33 -0.249 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -174.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.768 ' HD2' ' HG3' ' A' ' 950' ' ' GLU . 92.7 Cg_endo -82.04 -176.2 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.814 2.343 . . . . 0.0 109.568 156.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.958 ' HA ' ' HD2' ' A' ' 951' ' ' TYR . 8.9 Cg_endo -51.71 -41.15 63.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.456 2.104 . . . . 0.0 112.743 177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -64.69 -7.41 10.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.021 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.768 ' HG3' ' HD2' ' A' ' 947' ' ' PRO . 5.9 mm-40 -109.46 -17.09 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.261 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.958 ' HD2' ' HA ' ' A' ' 948' ' ' PRO . 31.8 m-85 -59.42 -37.3 77.7 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.058 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.41 -50.41 2.77 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.621 177.875 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.058 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.1 Cg_exo -56.31 -36.74 97.36 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.727 2.284 . . . . 0.0 114.854 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.705 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.6 ptp -60.14 -47.52 85.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.747 0.784 . . . . 0.0 108.973 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' 1002 ' ' MET . 61.8 t -65.22 -28.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.334 172.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.0 tptm -62.06 -37.34 84.63 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.484 ' HG3' ' HB3' ' A' ' 938' ' ' GLU . 71.1 mm-40 -55.74 -47.14 77.44 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.608 174.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 1.004 HG21 HD23 ' A' ' 998' ' ' LEU . 3.6 m -72.47 -28.88 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.791 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.579 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.39 -44.92 32.12 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.063 -1.065 . . . . 0.0 111.783 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.65 -31.72 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.82 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.41 -55.23 36.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.531 178.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.675 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 4.6 tt -65.34 -32.77 74.58 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.327 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.485 ' HD3' ' HA ' ' A' ' 963' ' ' ARG . 30.8 mmt180 -65.02 -48.64 73.19 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 122.009 -0.432 . . . . 0.0 111.583 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.451 HG22 ' OD1' ' A' ' 928' ' ' ASN . 11.1 m -60.04 -37.46 79.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.358 0.599 . . . . 0.0 109.937 172.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 3.2 tt -59.03 -30.43 68.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.49 173.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.523 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 52.5 tp -66.6 -31.44 72.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 970' ' ' ASP . . . -65.65 -41.45 92.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.942 0.877 . . . . 0.0 109.658 173.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 968' ' ' THR . . . . . 1.022 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -60.96 -38.6 86.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.742 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 70.7 t -55.4 -30.79 26.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.001 171.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.656 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.7 t70 -65.45 -29.59 70.28 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 122.406 -0.184 . . . . 0.0 111.313 177.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.614 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 54.2 mm-40 -65.95 -52.11 52.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 122.293 1.044 . . . . 0.0 109.658 172.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.531 ' HB3' ' CG1' ' A' 1039 ' ' ILE . 60.7 p -66.35 -23.3 66.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.153 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.857 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 65.1 tp -58.66 -54.72 53.39 Favored Pre-proline 0 C--O 1.217 -0.606 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.656 ' HD3' ' O ' ' A' ' 970' ' ' ASP . 26.1 Cg_exo -64.86 -25.55 60.18 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.397 1.535 . . . . 0.0 110.319 172.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 971' ' ' GLU . 5.3 t -75.6 -16.37 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 119.909 -0.717 . . . . 0.0 111.5 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.857 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 4.6 pp -80.45 -38.48 1.09 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 118.344 -0.836 . . . . 0.0 113.001 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.734 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 21.9 Cg_exo -66.34 -26.63 48.28 Favored 'Trans proline' 0 C--N 1.36 1.132 0 CA-C-N 121.578 1.599 . . . . 0.0 110.0 171.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 978' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' 1049 ' ' GLN . . . -69.84 -51.82 30.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.266 173.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.8 m -162.57 -48.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.962 HG22 ' HB ' ' A' ' 984' ' ' ILE . 51.4 m -46.92 -20.45 0.14 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.653 ' HB2' ' O ' ' A' ' 976' ' ' LEU . 19.5 t-80 -51.72 -20.15 1.97 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -76.81 -54.45 6.6 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.941 -177.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.077 ' HB2' HG22 ' A' 1038 ' ' VAL . 7.9 pm0 -78.64 -37.39 42.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 121.813 -0.554 . . . . 0.0 111.839 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.962 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.8 tp -62.03 -21.88 27.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.45 -47.13 51.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.059 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.487 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 22.7 ptp -72.26 -46.26 56.63 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.768 -170.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.65 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.73 -45.55 20.95 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -175.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.98 ' HA ' HD12 ' A' ' 991' ' ' LEU . 46.3 tt0 -62.21 -43.68 98.29 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.178 -175.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.445 ' NZ ' ' HB3' ' A' ' 989' ' ' LYS . 9.8 mtpm? -66.63 -32.61 74.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.415 0.626 . . . . 0.0 109.474 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 3.3 tp -65.13 -43.72 91.01 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.378 177.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.05 HD23 ' HB3' ' A' 1031 ' ' ASP . 22.8 mt -60.0 -45.98 90.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.01 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.94 -41.55 71.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.654 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.1 m -73.04 -34.37 66.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.256 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.686 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -103.97 -31.67 9.62 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -170.407 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.857 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -57.93 -38.46 75.96 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 165.634 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -55.57 -48.98 73.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.685 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -65.75 -32.31 73.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.718 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 1.004 HD23 HG21 ' A' ' 958' ' ' VAL . 14.1 tp -71.34 -26.78 62.97 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 119.11 -1.036 . . . . 0.0 108.898 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HG2' ' A' 1002 ' ' MET . 64.4 mt -62.36 -27.14 42.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.375 0.607 . . . . 0.0 109.605 169.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 77.5 m-20 -80.68 -6.71 58.77 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.665 ' HA ' ' HG3' ' A' 1021 ' ' MET . 58.2 tttm -80.07 -45.24 18.62 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 172.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.893 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 17.7 ptp -64.34 -38.0 89.47 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 175.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.822 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.6 tttp -67.87 -61.94 1.64 Allowed 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.712 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.648 ' HB2' ' O ' ' A' 1000 ' ' ASN . 4.8 tp -56.49 -56.08 25.72 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -173.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.6 -46.62 83.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.16 0.505 . . . . 0.0 110.785 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -24.14 54.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.952 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.822 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -69.07 -46.08 68.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.825 -173.456 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.63 ' HB2' ' CE2' ' A' 1017 ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 119.989 -0.684 . . . . 0.0 111.256 175.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.492 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -52.82 -38.27 61.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -165.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -47.19 -51.56 18.15 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.079 0.466 . . . . 0.0 111.684 171.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.641 ' HA ' HD23 ' A' 1004 ' ' LEU . 3.2 m-85 -68.33 -23.87 64.76 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.968 0.889 . . . . 0.0 109.204 -173.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.458 ' HE3' HD11 ' A' ' 943' ' ' ILE . 85.3 tttt -79.41 -41.66 27.17 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.05 176.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 79.0 tttt -77.96 -33.76 51.38 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.59 0.71 . . . . 0.0 111.643 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.01 -45.74 14.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.276 -0.874 . . . . 0.0 108.9 -171.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.665 ' HG3' ' HA ' ' A' 1001 ' ' LYS . 25.8 mmt -75.37 -17.74 60.14 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.824 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1018 ' ' LYS . 58.8 tp -63.45 -43.53 97.13 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 171.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.3 m -61.62 -28.65 69.52 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.3 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.82 -30.92 51.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.742 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -67.45 -40.61 85.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.327 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.534 ' O ' HG23 ' A' 1030 ' ' VAL . 14.8 t-80 -58.39 -38.02 76.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.103 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.0 -49.54 69.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.857 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -68.3 -29.05 67.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.34 0.59 . . . . 0.0 110.07 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.498 ' N ' HD23 ' A' 1028 ' ' LEU . . . -59.75 -42.68 93.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.604 172.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' 1026 ' ' HIS . 47.7 t -67.03 -31.4 53.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.957 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1031 ' ' ASP . . . . . 1.05 ' HB3' HD23 ' A' ' 991' ' ' LEU . 2.4 m-20 -56.19 -46.93 79.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.665 173.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.79 -53.53 57.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.313 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -54.1 -42.0 68.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.905 0.384 . . . . 0.0 111.646 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1034 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -63.72 -49.83 71.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.823 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.915 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -73.13 -27.57 61.75 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.468 ' N ' HG11 ' A' ' 929' ' ' VAL . 4.4 tt -57.5 -35.86 70.77 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.527 0.731 . . . . 0.0 110.737 177.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -92.51 -33.68 14.37 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.077 HG22 ' HB2' ' A' ' 983' ' ' GLU . 2.0 t -56.09 -46.57 80.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.367 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.2 tt -93.48 -28.51 4.38 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.938 -172.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 7.5 t70 -57.33 -42.81 82.61 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 161.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 15.2 mm100 -69.81 -31.44 69.35 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.707 174.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.588 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.82 -56.11 20.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.05 0.452 . . . . 0.0 110.553 171.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.2 tpt180 -57.29 -33.86 68.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.618 177.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.462 HD13 HH11 ' A' ' 920' ' ' ARG . 63.3 tp -69.01 -41.82 77.25 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 121.094 -0.243 . . . . 0.0 111.066 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.891 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 42.1 mmtm -51.09 -37.39 45.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.029 0.919 . . . . 0.0 110.079 174.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.435 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 28.0 ttt -68.82 -38.06 79.61 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.271 -1.331 . . . . 0.0 110.017 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' 1043 ' ' ARG . 42.8 mm -67.56 -36.3 75.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.38 173.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' 1045 ' ' LYS . 71.0 m -56.15 -51.39 68.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.305 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1049 ' ' GLN . . . . . 0.664 ' HG3' ' HB1' ' A' ' 978' ' ' ALA . 15.8 mm100 . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.219 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.73 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.624 0.25 . . . . 0.0 110.791 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 28.4 t -68.89 139.09 55.13 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 166.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.657 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.0 OUTLIER -72.02 67.91 0.66 Allowed 'General case' 0 CA--C 1.499 -1.002 0 C-N-CA 122.538 0.335 . . . . 0.0 111.524 -173.463 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 925' ' ' VAL . 8.2 t70 -47.87 -173.92 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 O-C-N 125.902 2.001 . . . . 0.0 112.325 -173.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 5.1 tmtp? -39.27 -19.76 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 124.042 0.937 . . . . 0.0 112.508 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.959 ' HA ' HG23 ' A' ' 968' ' ' THR . 3.7 m -62.01 -57.16 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 123.037 0.535 . . . . 0.0 112.193 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 23.3 t80 -78.97 -31.28 44.87 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 122.206 1.003 . . . . 0.0 108.764 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 7.8 mm-40 -60.84 -59.49 5.3 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.953 -1.476 . . . . 0.0 112.188 -175.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 13.0 t-20 -73.65 -32.54 64.05 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.671 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.7 p -62.63 -37.11 78.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 119.904 -0.719 . . . . 0.0 110.423 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.529 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 31.0 m -66.65 -33.94 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.291 0.567 . . . . 0.0 109.586 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.27 -31.07 65.29 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.381 173.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.718 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 25.9 tp -62.99 -41.78 99.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.004 0.43 . . . . 0.0 109.886 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 937' ' ' ILE . 48.2 t -62.3 -43.02 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 0.0 110.011 174.081 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -55.95 -40.89 73.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.724 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.36 -31.63 62.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.864 -177.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.627 ' HA ' HG22 ' A' ' 958' ' ' VAL . 13.0 p -77.41 -16.8 14.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.441 174.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.5 mm -72.55 -42.46 63.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 165.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 45.1 mt-10 -54.44 -37.2 64.87 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.937 172.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.553 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 42.9 ttp -57.94 -45.86 85.94 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.626 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.5 t -72.48 -32.84 66.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.857 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 24.0 m -77.64 -47.01 20.33 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.999 0.905 . . . . 0.0 109.968 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.563 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -78.86 -15.94 57.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.477 -174.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.855 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 6.8 tt -78.99 -25.62 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.106 172.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.699 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.2 mm-40 -50.93 -53.72 44.81 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.1 Cg_endo -104.43 36.26 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.09 1.86 . . . . 0.0 114.319 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.726 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -138.16 155.53 74.26 Favored Pre-proline 0 N--CA 1.466 0.33 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.528 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 50.5 Cg_endo -90.47 -176.72 1.1 Allowed 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 124.043 3.162 . . . . 0.0 112.091 176.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.765 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.8 Cg_exo -51.96 -31.77 44.99 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.976 2.451 . . . . 0.0 113.086 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.421 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 47.1 mt-10 -53.99 -36.17 62.63 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.557 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.726 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.4 mp0 -98.65 0.09 44.03 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.765 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 15.8 m-30 -61.27 -41.21 96.55 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.0 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -75.02 -51.25 3.64 Favored Pre-proline 0 CA--C 1.557 1.212 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.729 176.05 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.991 ' HD3' HG13 ' A' ' 952' ' ' VAL . 79.9 Cg_exo -51.54 -33.74 49.19 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.408 2.072 . . . . 0.0 115.112 173.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.855 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 27.3 ptt? -67.48 -45.84 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.182 0.515 . . . . 0.0 109.997 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.691 HG13 ' HG ' ' A' ' 998' ' ' LEU . 87.2 t -64.67 -27.14 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.502 173.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.7 ttpm? -59.4 -37.02 76.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.288 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -54.69 -46.09 74.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.882 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.627 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.1 t -69.95 -36.23 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.851 176.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.639 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.02 -44.46 67.16 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.358 -0.925 . . . . 0.0 112.872 -176.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.21 -32.34 72.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.884 0.374 . . . . 0.0 110.486 171.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.19 -55.92 21.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.616 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 1.8 tm? -63.8 -35.03 79.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.527 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -57.42 -57.38 12.93 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 121.827 -0.546 . . . . 0.0 111.114 171.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -55.81 -31.07 62.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.367 0.603 . . . . 0.0 110.65 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' 1035 ' ' LEU . 2.5 tm? -65.56 -39.87 92.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.057 176.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.5 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 8.6 tt -54.75 -33.53 61.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.043 176.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.25 79.27 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 110.317 174.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.959 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.4 m -56.03 -40.75 73.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.837 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.667 HG13 HD11 ' A' ' 984' ' ' ILE . 79.1 t -54.2 -32.0 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.681 173.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.779 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 24.9 t70 -68.06 -32.37 72.66 Favored 'General case' 0 C--O 1.219 -0.506 0 O-C-N 122.472 -0.143 . . . . 0.0 111.01 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.63 -53.0 63.13 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.78 1.276 . . . . 0.0 108.575 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.577 ' OG ' HG21 ' A' ' 980' ' ' THR . 26.7 t -65.42 -22.35 66.76 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.106 -1.406 . . . . 0.0 112.176 178.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.643 ' O ' ' HD3' ' A' ' 977' ' ' PRO . 6.4 tt -59.73 -54.96 50.57 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.916 -177.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.779 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.8 Cg_endo -58.84 -22.42 62.18 Favored 'Trans proline' 0 C--N 1.357 1.007 0 CA-C-N 121.58 1.6 . . . . 0.0 111.133 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.587 HG12 ' HB ' ' A' ' 980' ' ' THR . 60.0 t -74.35 -16.44 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.038 173.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 1.002 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -75.19 -41.37 3.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.42 -0.8 . . . . 0.0 112.409 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 1.002 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 23.7 Cg_exo -65.69 -27.07 52.91 Favored 'Trans proline' 0 C--N 1.361 1.219 0 CA-C-N 120.957 1.378 . . . . 0.0 110.354 171.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.06 -60.49 2.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.775 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.565 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 37.4 m -166.56 -34.2 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.817 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 1.5 t -63.38 -15.71 58.31 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -167.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.676 ' HA ' HG22 ' A' ' 984' ' ' ILE . 81.3 t60 -49.38 -21.03 0.78 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -71.29 -53.59 13.74 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.019 -0.673 . . . . 0.0 110.732 176.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.095 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -76.75 -42.69 40.1 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.676 HG22 ' HA ' ' A' ' 981' ' ' HIS . 11.3 tp -59.38 -28.54 39.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.892 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -73.53 -40.95 63.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.533 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.4 ptp -64.87 -57.48 8.72 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.055 -172.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.16 -42.04 27.08 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -174.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.974 ' HA ' HD12 ' A' ' 991' ' ' LEU . 41.6 tt0 -57.35 -42.91 82.92 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.213 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -68.62 -31.02 69.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.366 0.603 . . . . 0.0 109.512 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.793 ' HG ' ' CG ' ' A' 1031 ' ' ASP . 3.1 tp -75.42 -31.81 60.5 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.673 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.974 HD12 ' HA ' ' A' ' 988' ' ' GLN . 44.1 mt -64.71 -49.79 69.49 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.229 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -58.24 -40.39 81.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.535 -177.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 20.2 m -76.98 -35.33 57.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.465 -176.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.96 -31.48 12.15 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.052 ' HA ' HD22 ' A' 1028 ' ' LEU . 1.8 tm? -56.43 -37.64 70.5 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 162.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.564 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -60.42 -48.01 83.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.89 176.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.479 ' O ' ' HD3' ' A' 1001 ' ' LYS . 18.5 mt-10 -59.47 -37.09 77.31 Favored 'General case' 0 CA--C 1.504 -0.797 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.712 176.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.691 ' HG ' HG13 ' A' ' 955' ' ' VAL . 24.2 tp -68.63 -33.42 73.98 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.658 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.594 ' O ' ' HG2' ' A' 1002 ' ' MET . 33.8 pt -79.26 -25.24 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.911 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.516 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.4 m-80 -79.73 -17.06 54.43 Favored 'General case' 0 C--O 1.211 -0.968 0 O-C-N 122.219 -0.3 . . . . 0.0 110.349 167.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.69 ' CG ' ' HA ' ' A' 1021 ' ' MET . 0.3 OUTLIER -86.49 -31.71 21.17 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.619 178.342 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.0 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -69.18 -36.28 77.17 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 167.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.776 ' O ' ' HB2' ' A' 1007 ' ' GLN . 59.9 tttp -62.44 -56.14 20.99 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.921 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' 1000 ' ' ASN . 29.1 mt -58.88 -43.86 91.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.373 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.33 -46.78 85.56 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.134 0.492 . . . . 0.0 110.23 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.24 -19.2 56.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.16 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.776 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -76.21 -44.82 36.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.453 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.702 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.622 ' NE2' ' HE2' ' A' ' 951' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -54.98 -43.76 73.81 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.2 tt0 -50.27 -43.82 53.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.443 174.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.422 ' CE2' HD22 ' A' 1004 ' ' LEU . 2.1 m-30 -77.97 -23.4 48.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.547 0.213 . . . . 0.0 110.681 -179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' 1022 ' ' LEU . 39.3 ttpt -65.76 -37.0 85.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -71.29 -48.97 47.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.2 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' 1016 ' ' GLU . 70.7 mm-40 -52.13 -37.45 54.37 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 110.564 172.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.69 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 51.8 ttp -63.52 -50.21 70.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.75 176.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' 1018 ' ' LYS . 98.0 mt -61.9 -28.78 69.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.866 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 37.8 m -66.44 -36.73 83.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.489 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.57 -40.03 35.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.577 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.7 80.05 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.237 176.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' 1030 ' ' VAL . 13.9 t60 -54.79 -51.59 65.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.441 176.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.632 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.052 HD22 ' HA ' ' A' ' 995' ' ' LEU . 12.3 tp -73.39 -42.6 61.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.218 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.25 84.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' 1026 ' ' HIS . 54.7 t -67.03 -42.02 88.01 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.335 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.793 ' CG ' ' HG ' ' A' ' 990' ' ' LEU . 25.4 t0 -66.04 -32.29 73.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 176.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.12 -44.97 71.78 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 167.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.688 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 41.6 mtpt -70.84 -23.08 62.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.932 174.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.558 ' O ' HG23 ' A' 1038 ' ' VAL . 48.9 t30 -74.0 -43.79 56.8 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tp -79.85 -21.51 44.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.136 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.828 ' HA ' HG11 ' A' ' 929' ' ' VAL . 2.7 pp -72.08 -22.03 61.42 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.3 t70 -81.15 -48.08 12.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.506 168.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.095 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.4 t -47.89 -61.69 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.444 176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.712 HG12 ' HB ' ' A' ' 925' ' ' VAL . 8.7 tt -89.75 -25.47 5.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 CA-C-N 114.351 -1.295 . . . . 0.0 112.061 -167.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.855 ' O ' ' HG3' ' A' 1043 ' ' ARG . 18.5 t70 -63.34 -33.36 75.35 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 118.983 -1.087 . . . . 0.0 109.032 162.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' 1037 ' ' ASP . 60.6 mt-30 -76.61 -26.86 55.42 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 118.735 -1.186 . . . . 0.0 109.149 171.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.659 ' HA ' ' HB2' ' A' 1045 ' ' LYS . . . -55.01 -50.31 69.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 117.913 0.324 . . . . 0.0 110.581 171.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.855 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -53.39 -41.33 65.81 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.815 178.671 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.622 ' N ' ' HD2' ' A' 1043 ' ' ARG . 31.8 tp -79.85 -29.82 40.17 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 122.006 -0.434 . . . . 0.0 111.395 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.817 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 7.6 mptt -55.05 -46.39 75.35 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.811 0.844 . . . . 0.0 110.173 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 24.8 ttt -62.23 -45.01 95.26 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.715 178.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.467 ' CD1' ' HB2' ' A' ' 920' ' ' ARG . 1.7 mp -67.99 -21.48 26.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.573 176.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' 1045 ' ' LYS . 32.5 t -66.63 -36.85 83.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 0.0 110.422 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.225 179.839 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 1.134 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 120.729 0.3 . . . . 0.0 111.675 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.0 t -113.18 31.54 6.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.175 -175.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.472 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER 51.16 56.38 8.06 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.125 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.3 m-20 -47.26 -173.17 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.101 2.125 . . . . 0.0 112.932 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.8 tmtm? -40.27 -17.38 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.453 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.727 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -63.63 -53.23 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.767 174.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -77.55 -29.92 52.46 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 46.5 mt-10 -61.07 -60.73 3.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.278 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -41.74 82.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.247 -171.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.911 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.1 p -60.09 -37.8 74.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.255 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.423 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 28.1 m -68.59 -31.17 70.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.099 0.476 . . . . 0.0 110.069 173.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.56 -32.21 68.54 Favored Glycine 0 CA--C 1.521 0.463 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.149 172.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.988 HD12 ' HB2' ' A' 1032 ' ' ALA . 3.4 tm? -61.54 -45.48 93.98 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.3 t -58.86 -42.71 86.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.209 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.512 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.0 mmtp -67.14 -21.61 65.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.365 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.16 -31.61 44.05 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.757 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 936' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.98 -13.91 11.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 119.679 -0.809 . . . . 0.0 109.04 172.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 933' ' ' VAL . 45.9 mm -68.21 -43.04 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 164.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 6.4 mm-40 -54.05 -45.17 71.58 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.298 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.805 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.0 tmt? -57.59 -42.18 82.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.251 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 24.2 m -69.04 -30.51 68.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.104 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.599 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 16.7 m -78.33 -43.14 28.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.3 mmtp -56.16 -42.08 76.46 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 113.335 -1.757 . . . . 0.0 111.759 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.747 HD11 ' HE2' ' A' 1018 ' ' LYS . 13.9 tt -73.82 -23.26 18.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.05 -177.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 34.4 mm-40 -53.67 -62.75 3.26 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.2 Cg_endo -99.95 -4.0 0.61 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.545 1.496 . . . . 0.0 114.515 -175.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.638 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -114.15 150.19 43.22 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -170.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 3.4 Cg_exo -82.84 -178.56 3.95 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.223 3.282 . . . . 0.0 112.961 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.725 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 85.7 Cg_exo -50.03 -33.16 33.65 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 123.624 2.883 . . . . 0.0 114.269 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.62 -29.74 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.493 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.638 ' HG3' ' HB1' ' A' ' 946' ' ' ALA . 63.9 mm-40 -97.45 -4.95 37.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.108 177.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.725 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -56.34 -40.79 75.03 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 172.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.03 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.5 OUTLIER -77.13 -48.57 2.51 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.786 176.162 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.2 Cg_exo -52.56 -27.62 33.39 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 121.702 1.601 . . . . 0.0 114.6 172.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.805 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 19.9 ptp -74.2 -34.86 63.86 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.435 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -65.98 -26.76 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.745 171.665 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.717 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.2 tttm -53.24 -44.18 67.91 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 173.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.451 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 2.9 mm-40 -55.49 -47.67 75.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.818 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.477 HG21 HD23 ' A' ' 998' ' ' LEU . 5.0 m -75.31 -30.77 23.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.33 -45.29 31.01 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.873 -174.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.65 -27.3 68.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.81 0.338 . . . . 0.0 110.341 172.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.59 -52.78 62.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.673 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.6 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 2.8 tm? -66.53 -31.24 71.84 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.559 0.618 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.556 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 50.6 ttm-85 -64.61 -48.07 76.27 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 121.784 -0.572 . . . . 0.0 111.074 173.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 39.7 m -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.262 0.553 . . . . 0.0 110.11 171.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.552 HD11 ' HA ' ' A' ' 929' ' ' VAL . 0.5 OUTLIER -61.3 -39.42 90.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.668 176.719 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 52.4 tp -52.21 -32.9 38.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.646 174.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.72 98.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.435 0.636 . . . . 0.0 109.783 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.727 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.7 m -62.38 -38.66 90.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.241 172.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.683 HG13 HD11 ' A' ' 984' ' ' ILE . 93.6 t -54.05 -29.57 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.028 173.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 17.7 t70 -75.92 -25.59 56.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.798 -0.183 . . . . 0.0 111.041 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -66.92 -51.97 48.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.39 1.09 . . . . 0.0 109.163 171.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.407 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 33.3 p -63.7 -22.48 66.93 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.918 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.586 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 22.1 tp -54.45 -57.21 19.72 Favored Pre-proline 0 CA--C 1.54 0.579 0 CA-C-O 118.697 -0.668 . . . . 0.0 112.221 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 20.4 Cg_endo -64.16 -20.64 67.42 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.136 1.442 . . . . 0.0 111.167 173.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 1042 ' ' ALA . 54.5 t -75.17 -18.81 16.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.116 175.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.736 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.9 pp -74.89 -44.36 4.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.882 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.736 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 21.7 Cg_endo -64.3 -26.95 63.71 Favored 'Trans proline' 0 C--N 1.364 1.353 0 CA-C-N 121.145 1.445 . . . . 0.0 110.64 172.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.37 -59.84 3.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.593 172.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.596 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 75.2 m -160.82 -49.01 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.716 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 2.0 t -56.59 -14.35 3.11 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -166.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.603 ' HA ' HG22 ' A' ' 984' ' ' ILE . 20.8 p-80 -51.26 -22.88 3.01 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -170.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.49 ' HA ' ' NE ' ' A' ' 982' ' ' ARG . 4.1 tpm_? -78.69 -51.18 10.19 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 110.026 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.867 ' HG3' HG22 ' A' 1038 ' ' VAL . 2.7 tp10 -73.34 -42.77 61.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.964 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.683 HD11 HG13 ' A' ' 969' ' ' VAL . 0.1 OUTLIER -55.79 -40.18 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -173.563 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -73.37 -31.18 63.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.792 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptp -63.89 -49.13 73.93 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.876 -178.13 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.18 -39.12 34.17 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 116.876 -0.147 . . . . 0.0 111.174 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 1.094 ' HA ' HD12 ' A' ' 991' ' ' LEU . 5.5 tp60 -58.11 -47.6 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.799 -178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -60.83 -35.83 77.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.543 0.687 . . . . 0.0 109.47 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.449 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.4 OUTLIER -68.25 -45.0 74.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.757 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.094 HD12 ' HA ' ' A' ' 988' ' ' GLN . 3.8 mt -58.76 -55.8 30.39 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.546 0.689 . . . . 0.0 110.507 -177.143 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -59.93 -33.1 71.45 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.821 -171.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 12.2 p -74.55 -38.49 62.72 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.679 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 51.3 m-20 -103.17 -28.63 11.81 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.087 -172.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.9 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.56 -42.83 93.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.217 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.613 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -64.15 -44.35 92.39 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.926 175.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.626 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 38.2 tt0 -53.41 -46.55 69.79 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.492 176.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' 1002 ' ' MET . 28.2 tp -67.08 -38.55 85.95 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.898 -173.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.752 ' HA ' HG21 ' A' ' 955' ' ' VAL . 32.1 pt -61.05 -31.56 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.541 -178.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.624 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -95.32 -12.48 26.04 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.195 178.358 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.626 ' HG3' ' HG2' ' A' ' 997' ' ' GLU . 4.7 mmmm -84.74 -33.88 22.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.799 0.333 . . . . 0.0 110.453 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.698 ' SD ' ' HG3' ' A' 1021 ' ' MET . 72.7 mmm -74.4 -44.54 51.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 174.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 47.1 tttp -53.47 -44.27 68.83 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.872 167.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.717 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 18.1 tp -58.71 -49.02 79.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 175.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.687 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -59.12 -40.28 84.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.561 0.696 . . . . 0.0 109.671 175.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.616 ' HG3' HG12 ' A' ' 952' ' ' VAL . 1.1 tm0? -64.49 -33.3 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.733 173.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.4 tp60 -77.31 -24.36 50.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.123 -174.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.694 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.4 t80 . . . . . 0 C--N 1.32 -0.703 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.603 174.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 C--O 1.224 -0.278 0 CA-C-O 121.51 0.672 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' 1018 ' ' LYS . 12.1 tp60 -61.01 -38.47 86.2 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.528 -173.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -58.53 -36.15 73.42 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.401 -0.52 . . . . 0.0 111.406 171.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 0.7 OUTLIER -70.22 -23.36 62.92 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.416 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.747 ' HE2' HD11 ' A' ' 943' ' ' ILE . 64.6 tttm -80.33 -25.05 39.49 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.564 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -74.71 -54.14 7.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -53.1 -32.15 45.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.657 170.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.698 ' HG3' ' SD ' ' A' 1002 ' ' MET . 33.1 ttp -57.02 -49.0 77.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.591 175.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -64.02 -49.92 70.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -60.08 -37.57 80.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.147 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -73.78 -40.07 63.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.478 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.28 -34.85 79.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.614 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.56 ' O ' HG23 ' A' 1030 ' ' VAL . 76.4 t60 -74.28 -38.6 63.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.52 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.62 83.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 173.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.9 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -56.56 -46.04 80.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.007 176.233 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' 1033 ' ' LYS . . . -55.67 -30.85 61.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.478 176.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 1026 ' ' HIS . 57.7 t -71.94 -33.0 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.679 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 1.1 m-20 -51.77 -47.71 64.05 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.505 0.669 . . . . 0.0 109.3 172.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.988 ' HB2' HD12 ' A' ' 932' ' ' LEU . . . -66.46 -48.55 69.55 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.76 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.601 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 89.1 mttt -60.6 -39.67 88.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.716 -174.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' 1038 ' ' VAL . 65.5 t30 -71.26 -36.95 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.034 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.773 HD22 HD11 ' A' ' 991' ' ' LEU . 20.4 tp -77.84 -29.4 50.5 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.544 -177.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.911 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -68.35 -24.86 64.86 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' 1041 ' ' GLN . 38.6 t70 -81.8 -45.47 15.54 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.864 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.867 HG22 ' HG3' ' A' ' 983' ' ' GLU . 24.5 t -53.89 -62.16 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.806 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.77 HG12 ' O ' ' A' 1035 ' ' LEU . 8.2 pt -84.0 -27.46 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -173.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.612 ' O ' ' HG3' ' A' 1043 ' ' ARG . 26.5 t70 -61.06 -30.8 70.54 Favored 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 118.145 -1.422 . . . . 0.0 108.893 163.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.547 ' O ' ' HD3' ' A' 1045 ' ' LYS . 73.6 mt-30 -79.76 -24.04 41.81 Favored 'General case' 0 C--O 1.203 -1.394 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.677 169.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -58.22 -52.63 64.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.331 0.586 . . . . 0.0 109.822 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1043 ' ' ARG . . . . . 1.134 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 6.5 ppt_? -57.3 -32.09 66.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.677 176.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' 1043 ' ' ARG . 51.7 tp -78.95 -29.68 44.16 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.177 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.716 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 12.0 mptt -61.52 -43.23 99.23 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.684 0.793 . . . . 0.0 110.167 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.1 ttt -64.33 -35.03 79.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.567 176.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' 1043 ' ' ARG . 45.6 mm -70.72 -43.54 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.914 174.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.5 m -51.74 -33.01 32.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.014 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1049 ' ' GLN . . . . . 0.418 ' OE1' ' HA ' ' A' 1049 ' ' GLN . 6.8 tp60 . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.682 0.277 . . . . 0.0 111.042 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 25.0 tpt180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 63.9 m 68.92 -1.71 1.97 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.563 0.697 . . . . 0.0 110.626 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.885 ' OD1' ' HA ' ' A' 1040 ' ' ASP . 0.4 OUTLIER 64.77 74.66 0.39 Allowed 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 114.364 -1.289 . . . . 0.0 113.952 174.436 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.558 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.1 t70 -48.88 -173.77 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 111.907 -2.406 . . . . 0.0 113.277 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.662 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.0 tmtp? -41.08 -14.52 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.617 1.167 . . . . 0.0 112.88 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.768 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.5 m -63.6 -51.58 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 C-N-CA 122.959 0.503 . . . . 0.0 112.042 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.772 ' HB2' ' OD1' ' A' ' 922' ' ' ASN . 49.0 t80 -75.49 -34.12 60.85 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.257 1.027 . . . . 0.0 108.384 -178.088 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.625 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 40.5 mt-10 -64.94 -58.7 5.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 113.475 -1.693 . . . . 0.0 112.59 -176.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.662 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 3.6 t-20 -73.36 -31.02 63.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -171.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.735 ' CG2' HD11 ' A' 1039 ' ' ILE . 22.7 t -68.28 -35.86 72.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.793 176.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.48 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 90.5 m -56.86 -25.31 56.29 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.553 0.692 . . . . 0.0 109.969 163.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 931' ' ' GLY . . . . . 0.477 ' HA2' ' HG2' ' A' ' 934' ' ' LYS . . . -71.84 -26.88 71.76 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.526 176.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.729 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.4 tt -61.93 -41.35 97.84 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 172.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.65 ' O ' HG12 ' A' ' 937' ' ' ILE . 45.0 t -61.06 -45.2 99.03 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.979 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.499 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.3 mmpt? -54.67 -44.49 73.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.551 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.708 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.01 -28.65 60.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.7 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.8 p -77.62 -18.38 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 119.869 -0.732 . . . . 0.0 109.629 174.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 933' ' ' VAL . 34.8 mm -67.95 -26.08 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 169.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 35.5 mm-40 -64.9 -42.47 94.74 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.322 173.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.724 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.6 ptt? -55.64 -42.14 74.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.331 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 9.7 p -75.07 -35.22 61.85 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 12.1 p -77.6 -48.95 15.63 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.264 0.554 . . . . 0.0 111.067 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.465 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -68.64 -22.19 64.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.386 -176.169 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.69 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 10.4 tp -79.89 -22.75 11.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.669 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.709 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 33.7 mm-40 -49.3 -54.97 24.44 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.826 -0.17 . . . . 0.0 110.96 175.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 76.2 Cg_endo -95.24 30.22 0.21 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.614 1.543 . . . . 0.0 113.2 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.934 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -133.11 153.26 80.76 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -173.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.631 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.9 Cg_endo -92.88 -175.23 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.025 3.15 . . . . 0.0 111.968 174.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.911 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 9.7 Cg_endo -53.17 -30.53 51.01 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.875 2.384 . . . . 0.0 112.836 176.309 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.404 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 32.2 mm-40 -57.66 -29.52 64.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.061 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.934 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 48.9 mm-40 -102.02 0.86 35.76 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.088 0.243 . . . . 0.0 111.198 175.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.911 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 1.7 m-85 -59.26 -44.03 92.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.023 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -74.78 -48.09 4.93 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.392 176.144 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.023 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.7 Cg_exo -55.77 -23.63 42.56 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 121.696 1.598 . . . . 0.0 114.596 172.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.751 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 22.2 ptt? -73.32 -36.44 66.23 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.114 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 1.035 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -66.63 -27.22 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.085 172.763 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 83.1 tttt -55.15 -42.1 72.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 175.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.86 -47.44 71.0 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.462 173.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.623 HG12 ' HA ' ' A' ' 936' ' ' VAL . 0.9 OUTLIER -68.47 -23.59 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.223 176.611 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.568 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -66.26 -42.69 94.01 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 963' ' ' ARG . 84.5 mt -70.27 -10.27 58.43 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.27 0.557 . . . . 0.0 110.362 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -78.83 -56.24 4.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.925 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.717 HD12 ' HB3' ' A' ' 991' ' ' LEU . 2.6 tt -66.67 -29.06 68.99 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.285 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.504 ' HD2' HD23 ' A' ' 960' ' ' LEU . 54.9 mtt-85 -59.56 -61.42 2.63 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.069 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 5.3 m -56.1 -30.66 62.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.059 0.457 . . . . 0.0 110.95 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.727 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -67.12 -41.43 86.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.912 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -52.91 -35.48 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.377 174.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -60.91 -49.4 77.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.142 0.496 . . . . 0.0 110.068 175.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.2 m -58.24 -42.86 87.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.775 171.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.716 HG13 HD11 ' A' ' 984' ' ' ILE . 53.3 t -54.42 -30.96 22.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.422 0.153 . . . . 0.0 111.168 174.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.632 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 19.3 t70 -71.62 -26.09 62.43 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 177.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 975' ' ' VAL . 39.1 mm-40 -69.09 -44.89 71.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.383 1.087 . . . . 0.0 108.889 169.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.604 ' OG ' HG21 ' A' ' 980' ' ' THR . 33.4 t -66.36 -24.56 66.52 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.857 178.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.704 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.5 OUTLIER -60.71 -52.98 68.73 Favored Pre-proline 0 C--O 1.214 -0.783 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.639 -177.264 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.632 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.5 Cg_endo -58.71 -26.82 81.29 Favored 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.676 1.634 . . . . 0.0 111.373 170.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.567 HG13 ' HB2' ' A' 1046 ' ' MET . 2.1 t -75.82 -15.9 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.527 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 1.039 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -64.53 -52.68 50.73 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.695 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.669 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 31.5 Cg_exo -62.71 -30.26 78.25 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 121.409 1.406 . . . . 0.0 111.084 175.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.27 -57.33 10.8 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.173 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.824 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 17.1 m -165.49 -36.36 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.242 0.544 . . . . 0.0 112.194 -174.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.792 HG22 ' HB ' ' A' ' 984' ' ' ILE . 70.7 m -56.18 -22.71 30.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -173.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 1.039 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 24.7 p-80 -51.05 -30.02 14.45 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.054 0.843 . . . . 0.0 112.808 -172.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 40.3 mtm105 -62.28 -55.39 28.7 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.927 -0.709 . . . . 0.0 111.532 173.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.758 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.47 -47.29 23.44 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.471 -0.491 . . . . 0.0 112.198 -174.786 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.792 ' HB ' HG22 ' A' ' 980' ' ' THR . 13.0 tt -55.27 -37.97 45.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.429 -172.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 2.9 pp20? -73.28 -31.7 64.22 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.181 -178.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.741 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 18.0 ptp -62.54 -56.76 14.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.218 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.707 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.11 -33.16 44.62 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.802 ' HA ' HD12 ' A' ' 991' ' ' LEU . 57.7 tt0 -60.43 -44.69 95.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.306 -178.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.565 ' HG3' ' O ' ' A' ' 985' ' ' GLU . 28.0 mtmm -64.73 -34.04 77.39 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.555 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 3.0 tp -64.12 -46.31 84.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.495 177.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.042 HD11 ' HG ' ' A' 1035 ' ' LEU . 13.2 mt -54.51 -60.14 3.76 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.075 0.464 . . . . 0.0 110.568 175.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -50.99 -43.03 60.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.241 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.558 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 42.0 t -62.35 -56.94 13.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.957 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.46 ' O ' HD23 ' A' ' 998' ' ' LEU . 1.8 m-20 -83.15 -42.89 16.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -168.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.925 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.8 OUTLIER -53.1 -55.1 26.55 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.812 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.701 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -54.75 -43.82 73.04 Favored 'General case' 0 N--CA 1.46 0.067 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 174.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.735 ' O ' ' HG2' ' A' 1001 ' ' LYS . 36.5 mt-10 -54.24 -43.29 70.77 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.241 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.719 ' O ' ' HG2' ' A' 1002 ' ' MET . 4.1 mm? -63.64 -36.47 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.049 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.88 ' HA ' HG11 ' A' ' 955' ' ' VAL . 11.1 pt -71.04 -7.87 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 119.99 -0.684 . . . . 0.0 109.972 -177.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 13.7 m-80 -113.13 -15.3 12.8 Favored 'General case' 0 C--O 1.207 -1.145 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.735 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 21.8 mmmt -73.75 -32.73 63.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.443 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.035 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 12.3 mmt -78.55 -42.02 30.46 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.7 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 16.1 tppt? -55.4 -45.18 76.66 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.206 169.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' 1004 ' ' LEU . 14.6 mt -61.51 -48.21 82.1 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.687 0.617 . . . . 0.0 112.286 175.132 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.78 -44.1 86.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.169 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.63 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.2 pp0? -76.48 -16.56 59.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.841 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.684 ' HB2' ' O ' ' A' 1003 ' ' LYS . 43.9 tp60 -81.42 -36.72 29.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.315 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.586 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.2 t80 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.332 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.531 0.23 0 CA-C-O 120.588 0.233 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.96 -31.6 65.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' 1020 ' ' GLN . 34.8 tt0 -54.46 -54.31 42.63 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.849 170.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.586 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-85 -60.21 -35.88 76.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.007 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -62.12 -36.34 81.48 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.597 0.237 . . . . 0.0 110.974 171.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' 1016 ' ' GLU . 14.5 tppt? -63.28 -54.9 30.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.041 0.448 . . . . 0.0 110.063 175.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' 1016 ' ' GLU . 6.8 mm-40 -51.3 -37.77 49.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.212 173.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1021 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -65.69 -41.8 91.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.122 177.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 69.8 mt -60.5 -44.25 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 111.408 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.8 m -66.04 -46.7 76.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.232 0.539 . . . . 0.0 110.229 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.639 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -62.28 -43.41 98.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.191 178.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.486 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -60.39 -31.57 70.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.775 0.321 . . . . 0.0 111.009 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' 1030 ' ' VAL . 12.2 t-80 -75.76 -35.69 60.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.575 -0.45 . . . . 0.0 109.847 176.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.39 94.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.925 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.8 tt -56.29 -55.82 28.58 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.605 0.717 . . . . 0.0 111.004 171.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -52.98 -28.79 25.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.005 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' 1026 ' ' HIS . 77.4 t -74.11 -41.64 51.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 119.619 -0.229 . . . . 0.0 111.519 173.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.747 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -61.53 -46.93 87.85 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.09 177.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -53.77 -40.46 66.25 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.79 169.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 88.6 tttt -77.37 -35.04 54.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.424 0.631 . . . . 0.0 110.246 -172.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.453 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -75.41 -45.57 38.1 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.988 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1035 ' ' LEU . . . . . 1.042 ' HG ' HD11 ' A' ' 991' ' ' LEU . 3.4 tm? -67.99 -33.68 75.09 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.96 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' 1040 ' ' ASP . 4.2 pp -64.74 -29.34 70.32 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.48 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 20.8 t70 -84.98 -37.67 20.17 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.887 0.742 . . . . 0.0 109.511 178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.758 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 5.7 t -52.88 -52.97 23.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.654 172.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.808 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 24.4 pt -90.48 -22.77 6.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.885 ' HA ' ' OD1' ' A' ' 922' ' ' ASN . 6.2 t70 -44.81 -49.26 10.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 157.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 76.7 mt-30 -78.44 -27.33 46.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.481 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.808 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.68 -56.12 22.53 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 118.333 0.515 . . . . 0.0 111.46 175.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.608 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.1 OUTLIER -57.82 -32.3 67.45 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.336 176.49 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.87 -13.1 59.99 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.762 174.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.7 mmtp -73.24 -35.47 66.26 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 59.8 ttm -66.42 -40.65 89.66 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.669 173.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.03 -35.0 62.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.794 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 22.3 t -70.12 -33.87 72.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.02 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 21.9 tp60 . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.743 -178.464 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.678 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 2.1 tpm_? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 35.2 t 73.53 -0.24 3.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.035 0.534 . . . . 0.0 111.668 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.4 OUTLIER 52.54 68.75 0.78 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-O 121.598 0.714 . . . . 0.0 111.247 175.12 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 925' ' ' VAL . 45.3 t0 -45.1 -171.78 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 112.105 -2.316 . . . . 0.0 112.687 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.688 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.3 tmtp? -34.9 -21.44 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.392 1.077 . . . . 0.0 113.007 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.817 HG21 ' HB2' ' A' 1043 ' ' ARG . 0.5 OUTLIER -56.36 -56.17 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 172.942 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -78.02 -30.54 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.156 0.979 . . . . 0.0 108.527 -177.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 86.4 mt-10 -60.31 -50.92 71.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.978 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.493 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 32.3 t-20 -66.1 -44.46 84.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.346 -174.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' 1036 ' ' LEU . 4.1 t -62.44 -30.97 50.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.057 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.539 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 56.4 m -64.05 -34.77 78.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.881 0.848 . . . . 0.0 109.146 171.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.95 -28.0 62.94 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.85 172.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.998 HD12 HD13 ' A' ' 965' ' ' LEU . 3.7 tt -66.92 -49.17 66.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 117.455 0.627 . . . . 0.0 109.745 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 937' ' ' ILE . 3.4 m -63.01 -32.24 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.895 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.539 ' HD2' ' O ' ' A' ' 930' ' ' THR . 1.3 mpmm? -65.07 -28.41 69.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.854 0.359 . . . . 0.0 110.994 174.257 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.664 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.14 -26.03 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 0.0 111.265 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.574 ' HA ' HG12 ' A' ' 958' ' ' VAL . 9.7 p -80.81 -10.43 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.124 172.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.7 mm -71.86 -36.87 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 166.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 41.2 mt-10 -57.74 -45.05 86.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.668 170.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.58 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.2 -45.2 91.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.682 176.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.732 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.9 t -64.27 -37.98 89.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.308 -177.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.573 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.5 p -77.11 -38.87 51.3 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 -176.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.646 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.7 mmtp -52.87 -49.96 64.79 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.683 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.738 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.2 tt -71.1 -23.74 23.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.811 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 84.7 mm-40 -59.38 -64.75 2.6 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -175.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.811 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -101.29 5.55 0.59 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.667 1.578 . . . . 0.0 113.832 -174.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -110.62 157.22 38.98 Favored Pre-proline 0 C--N 1.323 -0.572 0 C-N-CA 120.627 -0.429 . . . . 0.0 112.098 -173.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.99 176.37 9.46 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.417 2.744 . . . . 0.0 112.237 177.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.719 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 77.7 Cg_exo -53.29 -24.93 28.72 Favored 'Trans proline' 0 C--O 1.245 0.863 0 C-N-CA 123.318 2.679 . . . . 0.0 113.289 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -54.55 -31.27 56.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.097 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.553 ' OE1' ' HE2' ' A' ' 942' ' ' LYS . 10.7 mm-40 -100.96 1.18 39.48 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.323 178.596 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.719 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 13.7 m-30 -64.27 -39.01 93.07 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 172.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.037 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -73.18 -51.22 6.08 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.591 174.856 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.007 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.3 Cg_exo -51.62 -36.86 62.24 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.157 1.905 . . . . 0.0 114.742 172.267 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.738 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 26.4 ptt? -62.71 -46.99 85.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.394 0.616 . . . . 0.0 110.054 -177.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.586 ' O ' HG22 ' A' ' 958' ' ' VAL . 89.4 t -68.21 -26.55 34.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 173.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 87.3 tttt -58.75 -38.11 77.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 6.1 mm-40 -55.37 -46.88 76.45 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.855 174.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.5 m -74.24 -22.35 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 O-C-N 122.202 -0.311 . . . . 0.0 111.829 177.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.566 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.48 -44.0 66.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.135 -1.031 . . . . 0.0 111.479 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.3 mm? -64.42 -27.78 69.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.588 0.232 . . . . 0.0 110.768 171.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.686 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.62 -56.91 16.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.218 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 991' ' ' LEU . 5.1 tt -63.03 -36.57 84.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.191 -0.204 . . . . 0.0 111.057 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 46.1 ttt180 -59.85 -53.47 57.51 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 176.021 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.8 m -55.92 -40.9 73.76 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.848 0.832 . . . . 0.0 109.914 174.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.998 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -60.78 -29.51 69.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.851 176.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.436 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.1 tp -68.03 -29.56 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.549 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.33 -38.33 90.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.352 0.596 . . . . 0.0 109.668 173.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.754 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.3 m -71.2 -33.69 70.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.101 174.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 965' ' ' LEU . 78.6 t -55.12 -30.99 24.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.537 171.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.49 ' HA ' ' HB2' ' A' ' 973' ' ' LEU . 24.6 t70 -77.87 -26.23 49.12 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 177.245 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.549 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.5 mm-40 -65.91 -54.25 28.93 Favored 'General case' 0 C--O 1.25 1.079 0 CA-C-O 123.344 1.545 . . . . 0.0 108.514 170.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.439 ' O ' HD13 ' A' ' 976' ' ' LEU . 46.6 t -62.84 -26.94 69.0 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.657 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.761 ' HA ' HD13 ' A' ' 976' ' ' LEU . 4.9 tt -57.33 -52.99 70.09 Favored Pre-proline 0 N--CA 1.472 0.674 0 CA-C-O 118.597 -0.716 . . . . 0.0 112.421 -174.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 51.7 Cg_exo -55.19 -30.75 72.82 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.178 1.456 . . . . 0.0 110.541 170.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 2.6 t -77.05 -13.71 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.618 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.878 ' HG ' HG21 ' A' ' 984' ' ' ILE . 5.8 mp -61.72 -64.45 3.07 Favored Pre-proline 0 N--CA 1.472 0.66 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.8 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.741 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 17.3 Cg_endo -58.21 -28.19 83.24 Favored 'Trans proline' 0 C--N 1.364 1.361 0 C-N-CA 121.505 1.47 . . . . 0.0 111.291 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 978' ' ' ALA . . . . . 0.629 ' O ' ' HG3' ' A' 1049 ' ' GLN . . . -59.52 -52.2 66.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.513 173.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 979' ' ' SER . . . . . 1.052 ' HB3' ' HB3' ' A' 1045 ' ' LYS . 3.5 t -171.58 -33.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.034 0.445 . . . . 0.0 112.044 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.985 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.0 m -63.81 -22.19 66.79 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -172.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.448 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.8 t-80 -53.21 -21.56 5.38 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -175.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -76.1 -54.78 6.33 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.162 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.762 ' CG ' HG22 ' A' 1038 ' ' VAL . 3.4 tp10 -74.49 -43.14 57.35 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.426 -0.509 . . . . 0.0 111.374 -178.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.985 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.2 OUTLIER -59.45 -37.71 71.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -174.527 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.27 -43.88 83.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.543 174.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.696 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.8 ptm -63.02 -47.91 81.04 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.143 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.791 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -79.44 -43.54 23.09 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.839 ' HA ' HD12 ' A' ' 991' ' ' LEU . 61.5 tt0 -60.27 -45.98 91.42 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.974 -0.291 . . . . 0.0 111.544 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -66.54 -31.02 71.47 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.413 ' HG ' ' HB2' ' A' 1031 ' ' ASP . 1.8 tp -65.93 -40.39 91.36 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.359 175.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.043 HD11 HD22 ' A' 1035 ' ' LEU . 18.5 mt -58.07 -56.28 24.13 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.519 0.676 . . . . 0.0 110.557 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.99 -31.8 63.36 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.75 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.5 m -76.07 -36.34 59.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.838 -177.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -102.55 -31.47 10.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.06 -174.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.876 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.5 tm? -59.41 -41.25 89.06 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 168.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -63.61 -44.63 93.37 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.152 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.52 ' O ' ' HD3' ' A' 1001 ' ' LYS . 19.2 mm-40 -53.14 -43.33 66.9 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.681 173.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' 1028 ' ' LEU . 2.4 mt -67.26 -28.97 68.47 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.74 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 995' ' ' LEU . 44.0 mm -66.23 -43.21 91.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.837 177.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.589 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.2 m-20 -79.31 -15.2 58.31 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.853 177.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.52 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -87.17 -36.83 17.81 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.204 0.315 . . . . 0.0 111.371 178.464 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.037 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -65.71 -39.48 91.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 169.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 58.9 tttm -62.56 -53.31 56.54 Favored 'General case' 0 C--O 1.204 -1.322 0 CA-C-N 114.021 -1.445 . . . . 0.0 108.511 174.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' 1000 ' ' ASN . 21.5 tp -49.29 -56.38 9.64 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.352 1.061 . . . . 0.0 113.489 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.84 -45.85 89.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.479 0.657 . . . . 0.0 110.18 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.4 pp0? -76.54 -11.06 59.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.086 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -81.27 -40.31 23.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.267 -176.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.545 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 11.7 m-85 . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.807 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.501 ' HA ' ' HD2' ' A' 1017 ' ' TYR . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -55.07 -34.83 63.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.555 ' HG2' ' CE1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -48.05 -50.31 28.43 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.825 0.821 . . . . 0.0 110.882 168.423 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.588 ' HB3' ' HG ' ' A' 1004 ' ' LEU . 14.5 m-85 -78.98 -20.06 50.08 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.668 -175.301 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.507 ' O ' ' HG ' ' A' 1022 ' ' LEU . 19.0 ttmm -72.34 -33.13 67.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.211 169.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.416 ' HB3' ' HE3' ' A' 1019 ' ' LYS . 20.6 mmmt -74.42 -56.67 4.59 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.566 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.511 ' HG3' ' O ' ' A' 1016 ' ' GLU . 44.2 mt-30 -50.8 -31.7 17.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.466 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 14.9 tmm? -67.85 -45.95 73.14 Favored 'General case' 0 C--O 1.23 0.06 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.266 175.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' 1018 ' ' LYS . 95.8 mt -60.54 -40.14 90.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.874 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 24.8 m -62.59 -34.17 76.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 0.0 110.582 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.42 -42.04 31.23 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.069 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.504 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -61.83 -38.43 88.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.05 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.6 ' O ' HG23 ' A' 1030 ' ' VAL . 19.0 t-80 -69.08 -47.92 64.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.375 178.087 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.14 -34.94 75.8 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.441 0.463 . . . . 0.0 110.427 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.7 OUTLIER -63.12 -50.05 72.0 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.685 0.755 . . . . 0.0 110.385 174.688 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.56 -37.53 68.13 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.053 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 1026 ' ' HIS . 57.2 t -67.57 -30.57 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.351 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.7 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -75.14 -39.35 60.55 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.711 -0.795 . . . . 0.0 109.029 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.423 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.19 -53.16 59.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.19 172.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.521 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 27.0 mtpp -61.89 -39.73 92.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.814 -177.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.625 ' O ' HG23 ' A' 1038 ' ' VAL . 15.0 t-20 -68.55 -38.01 80.43 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.111 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1035 ' ' LEU . . . . . 1.043 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.36 -26.08 46.56 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.09 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.57 ' HB3' ' HB ' ' A' ' 929' ' ' VAL . 4.4 pp -74.11 -21.57 59.84 Favored 'General case' 0 C--O 1.211 -0.944 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.433 ' O ' ' HG3' ' A' 1041 ' ' GLN . 3.9 m-20 -82.23 -46.53 13.59 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 123.967 0.792 . . . . 0.0 109.163 170.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.791 HG21 ' HB2' ' A' ' 987' ' ' ALA . 29.0 t -50.6 -57.07 2.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.482 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.812 ' CG2' ' HB ' ' A' ' 925' ' ' VAL . 17.2 mt -73.36 -35.97 47.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.95 -177.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' 1036 ' ' LEU . 5.0 t70 -50.98 -45.46 60.96 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 166.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 71.7 mt-30 -72.57 -29.34 63.45 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.09 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' 1045 ' ' LYS . . . -54.03 -58.03 8.82 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 121.043 0.449 . . . . 0.0 111.777 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.817 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.6 OUTLIER -59.51 -28.83 67.41 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.356 177.714 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 40.1 tp -77.42 -25.82 51.1 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.451 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1045 ' ' LYS . . . . . 1.052 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 3.6 mmpm? -63.33 -33.59 75.86 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.855 0.836 . . . . 0.0 109.091 175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.9 ttt -64.72 -43.6 92.91 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.301 -1.318 . . . . 0.0 109.275 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.496 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.1 mm -60.85 -43.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.0 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' 1045 ' ' LYS . 66.3 m -53.97 -29.61 43.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.219 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1049 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' ' 978' ' ' ALA . 26.5 mm-40 . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -176.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 1.018 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 38.2 m 74.27 22.75 2.17 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.888 0.742 . . . . 0.0 111.034 -174.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 1.018 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 44.02 55.65 5.2 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.999 176.091 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 925' ' ' VAL . 14.0 m-20 -46.52 -175.15 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.487 0 O-C-N 125.121 1.513 . . . . 0.0 112.582 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.556 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 5.4 tmtp? -33.06 -24.76 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.667 1.187 . . . . 0.0 113.243 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.799 HG21 ' HB2' ' A' 1043 ' ' ARG . 4.9 m -61.85 -53.38 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-O 119.194 -0.431 . . . . 0.0 112.081 175.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.601 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 71.2 t80 -78.4 -27.29 46.69 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.546 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.5 mt-10 -64.97 -61.12 2.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.901 -178.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.556 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -70.02 -34.53 73.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.11 -172.726 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.96 ' HB ' HD11 ' A' 1039 ' ' ILE . 12.7 p -62.36 -34.76 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.816 175.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.543 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -68.1 -35.36 78.03 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.94 -28.39 63.46 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.416 172.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.66 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.5 tt -63.39 -42.93 98.83 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 175.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 937' ' ' ILE . 42.4 t -63.97 -38.12 81.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.263 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 934' ' ' LYS . 10.5 mmpt? -65.11 -33.95 77.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.992 0.425 . . . . 0.0 110.469 177.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -76.2 -26.13 55.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.338 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.722 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -83.38 -14.14 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.673 173.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.591 HG12 ' O ' ' A' ' 933' ' ' VAL . 39.7 mm -70.08 -35.79 65.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 166.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.609 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 46.5 mt-10 -54.35 -43.65 71.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.365 170.369 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.641 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.2 ttp -58.46 -43.59 88.93 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.596 0.56 . . . . 0.0 110.356 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.576 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 16.7 m -65.6 -37.18 85.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.093 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.6 m -77.3 -43.06 34.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -177.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.695 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.4 mmtm -49.94 -57.65 7.05 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.601 -1.636 . . . . 0.0 111.259 176.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 12.9 tt -62.5 -29.27 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.786 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.5 mt-30 -50.29 -60.69 4.8 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.786 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 18.1 Cg_endo -93.37 0.94 3.44 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.499 1.466 . . . . 0.0 113.879 177.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.884 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -90.16 148.43 39.3 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.57 175.34 6.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.902 3.068 . . . . 0.0 110.064 165.153 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.641 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 9.9 Cg_endo -51.87 -31.01 40.94 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.742 2.295 . . . . 0.0 112.511 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.54 -33.27 67.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.081 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.884 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -98.73 -0.27 43.11 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 122.953 0.158 . . . . 0.0 111.297 175.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.726 ' O ' ' HG2' ' A' ' 954' ' ' MET . 10.1 m-30 -65.55 -37.84 87.88 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 175.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.094 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -78.42 -45.16 2.08 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.163 173.447 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.094 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.4 Cg_exo -53.81 -28.43 47.94 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.829 1.686 . . . . 0.0 113.999 170.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 16.6 ptt? -72.87 -37.89 67.21 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.465 178.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.785 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -64.82 -26.49 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.702 171.494 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 55.7 tttt -57.0 -40.77 77.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -55.67 -46.17 77.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.49 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 936' ' ' VAL . 1.6 m -72.77 -22.7 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 120.798 0.332 . . . . 0.0 111.179 176.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.57 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.28 -44.27 66.56 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.175 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.2 mm? -63.78 -24.07 67.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.948 172.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -61.1 -57.82 10.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.324 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.69 ' HB2' HD13 ' A' ' 995' ' ' LEU . 22.8 tp -68.71 -34.42 75.61 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.637 -0.425 . . . . 0.0 112.016 178.223 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 959' ' ' GLY . 75.1 mtp180 -59.57 -55.23 37.1 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.772 -0.58 . . . . 0.0 112.437 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.44 HG22 ' OD1' ' A' ' 928' ' ' ASN . 14.7 m -57.88 -34.7 70.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.584 0.707 . . . . 0.0 110.242 174.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.674 HD11 HD21 ' A' 1035 ' ' LEU . 3.0 tm? -63.81 -29.0 70.24 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.235 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.476 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 0.2 OUTLIER -66.94 -28.16 68.06 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.687 -178.839 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.06 89.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.381 0.61 . . . . 0.0 109.836 172.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.747 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.3 m -58.55 -39.68 80.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.61 172.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.555 HG13 HD11 ' A' ' 984' ' ' ILE . 72.7 t -54.07 -30.55 20.22 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.307 174.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.2 t70 -74.65 -24.06 58.77 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.59 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.6 mm-40 -71.91 -51.22 23.28 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.83 1.3 . . . . 0.0 109.135 169.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.422 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 30.9 t -65.45 -24.56 67.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.803 -1.544 . . . . 0.0 111.056 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.652 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 28.4 tp -63.76 -50.17 72.61 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-O 118.468 -0.777 . . . . 0.0 112.454 -175.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.613 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.8 Cg_exo -59.23 -26.49 81.98 Favored 'Trans proline' 0 C--N 1.356 0.964 0 CA-C-N 121.096 1.427 . . . . 0.0 110.827 169.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' 1042 ' ' ALA . 38.7 t -75.09 -16.71 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.726 174.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.813 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 0.3 OUTLIER -64.57 -54.85 33.78 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.81 176.231 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 29.2 Cg_exo -62.2 -25.61 77.09 Favored 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 120.962 1.379 . . . . 0.0 110.406 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -68.11 -61.6 1.78 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.656 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.896 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 9.6 m -163.45 -50.22 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -172.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.529 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 4.9 t -53.28 -15.99 1.15 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -172.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.813 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 8.9 p-80 -47.94 -20.78 0.35 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 982' ' ' ARG . 9.1 tpt180 -76.86 -52.24 9.83 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.465 -0.894 . . . . 0.0 110.488 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.989 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.0 OUTLIER -76.61 -39.07 53.61 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.757 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' ' 981' ' ' HIS . 10.6 tt -63.06 -25.35 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.891 -176.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -73.5 -40.85 63.75 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.303 171.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.597 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 15.7 ptp -70.9 -51.2 27.63 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.842 -0.743 . . . . 0.0 112.052 -173.315 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.554 ' CB ' HG21 ' A' 1038 ' ' VAL . . . -78.76 -40.12 34.22 Favored 'General case' 0 C--O 1.217 -0.625 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' A' ' 991' ' ' LEU . 49.3 tt0 -61.56 -44.75 96.46 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.208 -177.278 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.43 -26.18 64.48 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.572 0.701 . . . . 0.0 109.136 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 8.6 tp -72.25 -37.35 69.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.823 178.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.036 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.4 mt -61.58 -53.42 56.5 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.982 176.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -57.03 -37.49 71.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.494 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 4.5 p -71.65 -38.03 70.75 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -176.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.639 ' HA ' ' HB3' ' A' ' 997' ' ' GLU . 4.3 m-20 -106.77 -31.13 8.54 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 119.529 -0.868 . . . . 0.0 112.825 -172.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.017 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.7 OUTLIER -59.79 -45.46 92.22 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.361 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.24 91.16 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.848 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.728 ' O ' ' HB2' ' A' 1001 ' ' LYS . 7.7 tp10 -53.03 -41.07 64.36 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.056 174.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.667 HD23 HD13 ' A' 1028 ' ' LEU . 40.9 tp -68.31 -38.99 82.14 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.243 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.785 ' HA ' HG11 ' A' ' 955' ' ' VAL . 77.7 mt -57.57 -51.21 72.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.298 0.57 . . . . 0.0 110.64 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.639 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.1 OUTLIER -78.47 -11.72 59.97 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.531 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.728 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 0.8 OUTLIER -84.42 -32.95 23.83 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.311 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 998' ' ' LEU . 43.7 mmm -78.71 -39.49 36.33 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' 1007 ' ' GLN . 84.1 tttt -55.79 -51.01 68.91 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.536 -1.211 . . . . 0.0 108.488 169.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.7 tp -57.28 -46.2 83.33 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.422 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -60.57 -44.48 96.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.385 0.612 . . . . 0.0 110.35 178.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.0 pp0? -76.68 -10.66 59.54 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.446 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' A' 1003 ' ' LYS . 28.7 tp60 -87.95 -16.71 33.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.413 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 60.9 t80 . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.951 -176.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.527 0.081 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.702 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 19.7 pt20 -61.69 -32.28 72.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.453 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -50.44 -42.87 54.75 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 111.602 0.223 . . . . 0.0 111.602 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.609 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 4.5 m-30 -84.6 -19.62 32.74 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.225 0.536 . . . . 0.0 110.219 178.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.7 tttm -75.37 -32.11 60.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.49 177.208 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -76.44 -41.2 48.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -48.46 -40.14 25.3 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.554 166.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.623 ' HB3' ' O ' ' A' 1018 ' ' LYS . 1.3 tmt? -57.22 -46.71 82.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.252 173.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.57 -38.4 89.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.36 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.1 m -68.51 -37.08 79.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.894 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.91 -41.57 36.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.643 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.571 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -63.05 -31.79 73.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.258 0.552 . . . . 0.0 110.497 178.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' 1030 ' ' VAL . 6.0 t60 -71.64 -44.13 64.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.775 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.86 94.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.698 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 995' ' ' LEU . 5.5 tt -55.63 -53.53 55.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.178 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.77 -31.09 64.27 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.573 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.748 ' HA ' ' HG2' ' A' 1033 ' ' LYS . 80.6 t -66.06 -43.51 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.867 174.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.561 ' HB3' HD23 ' A' ' 991' ' ' LEU . 8.4 m-20 -51.35 -46.4 62.68 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.05 0.452 . . . . 0.0 109.838 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.652 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -60.9 -53.25 59.54 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.117 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.748 ' HG2' ' HA ' ' A' 1030 ' ' VAL . 15.0 ptmm? -65.75 -32.14 73.52 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -174.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.677 ' O ' HG23 ' A' 1038 ' ' VAL . 6.7 t-20 -73.43 -36.85 66.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.511 -0.475 . . . . 0.0 109.998 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.91 HD22 HD11 ' A' ' 991' ' ' LEU . 9.9 tp -79.81 -26.96 40.34 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.713 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.9 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.9 pp -64.79 -27.11 68.67 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.557 ' O ' ' HG2' ' A' 1041 ' ' GLN . 31.4 t70 -75.31 -45.91 36.7 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.219 -1.355 . . . . 0.0 108.921 170.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.989 HG13 ' HB3' ' A' ' 983' ' ' GLU . 55.7 t -53.31 -61.27 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.758 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.107 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.96 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.8 pt -81.33 -32.7 12.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -172.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 8.6 t0 -54.6 -44.53 73.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.201 166.247 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' A' 1045 ' ' LYS . 4.4 pt20 -78.47 -22.61 47.27 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.852 177.474 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.624 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.58 -55.35 30.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 118.478 0.581 . . . . 0.0 110.064 169.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.799 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.0 tpt180 -55.56 -33.86 64.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.131 175.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.507 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 66.1 tp -76.56 -26.3 54.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.439 175.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.896 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 69.0 mmtt -64.24 -34.63 78.55 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.0 ttp -71.41 -40.87 70.22 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.804 -1.543 . . . . 0.0 109.203 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.494 ' HB ' HD12 ' A' 1044 ' ' LEU . 48.6 mm -62.32 -35.02 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.809 172.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' 1045 ' ' LYS . 31.2 t -60.7 -40.19 91.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.316 -175.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 . . . . . 0 C--N 1.325 -0.457 0 C-N-CA 120.561 -0.455 . . . . 0.0 111.621 -177.0 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.84 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 6.7 tpt180 . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -75.73 39.88 0.18 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.757 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.794 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.1 OUTLIER 43.32 69.93 0.35 Allowed 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 124.229 1.011 . . . . 0.0 111.801 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 925' ' ' VAL . 2.1 t70 -47.02 -173.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 O-C-N 126.042 2.089 . . . . 0.0 113.058 -171.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.543 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 0.6 OUTLIER -46.54 -12.11 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.605 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.744 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -65.4 -54.65 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.751 171.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.458 ' CD1' ' HB2' ' A' 1040 ' ' ASP . 52.2 t80 -78.88 -29.13 44.21 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 122.144 0.973 . . . . 0.0 108.64 -176.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 38.5 mt-10 -65.41 -62.47 1.51 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.075 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.56 -32.52 68.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.985 -170.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.877 HG23 HD11 ' A' ' 965' ' ' LEU . 14.4 p -60.6 -38.02 77.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.44 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.546 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 55.6 m -65.49 -32.85 74.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 172.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.82 -33.2 67.44 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.866 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.533 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 21.0 tp -62.7 -43.0 99.93 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 117.383 0.591 . . . . 0.0 109.43 174.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 937' ' ' ILE . 27.4 t -63.53 -42.08 94.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.689 176.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.581 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.9 mmpt? -65.27 -31.01 71.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.02 -25.14 43.27 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.479 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.64 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.7 p -81.99 -11.32 12.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 C-N-CA 119.728 -0.789 . . . . 0.0 109.228 171.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 46.5 mm -72.34 -36.19 54.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 165.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.6 mm-40 -53.15 -38.05 62.39 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.372 170.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.511 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 57.5 ttp -58.16 -45.45 87.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.793 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.611 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 48.3 m -65.46 -33.07 75.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.666 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.765 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.2 m -77.46 -37.03 52.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.986 0.898 . . . . 0.0 108.943 -177.426 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.2 mmtp -70.01 -29.7 66.82 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.901 -1.499 . . . . 0.0 111.671 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 1.035 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 15.4 tt -79.49 -23.29 12.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.318 0.58 . . . . 0.0 110.462 178.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 940' ' ' SER . 84.2 mm-40 -55.27 -56.02 33.2 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 941' ' ' SER . 13.4 Cg_endo -91.31 -4.08 4.35 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.766 1.644 . . . . 0.0 115.421 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 950' ' ' GLU . . . -129.86 162.0 56.15 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.544 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 3.2 Cg_exo -80.61 -178.83 4.7 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 124.283 3.322 . . . . 0.0 110.908 168.22 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.929 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 5.9 Cg_endo -47.59 -18.37 0.9 Allowed 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 124.712 3.608 . . . . 0.0 115.689 -168.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.38 -4.18 1.73 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 170.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 1.035 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.1 OUTLIER -96.03 -27.87 14.9 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 173.155 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.929 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 11.1 m-85 -43.53 -47.36 7.28 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.046 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -69.75 -59.58 4.48 Favored Pre-proline 0 CA--C 1.555 1.152 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.814 177.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.046 ' HD3' HG13 ' A' ' 952' ' ' VAL . 51.2 Cg_exo -59.33 -35.92 95.66 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.338 2.026 . . . . 0.0 114.873 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.73 ' HE2' ' HA ' ' A' ' 951' ' ' TYR . 24.0 ptt? -64.01 -47.61 79.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -177.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' 1002 ' ' MET . 72.0 t -66.32 -27.0 39.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.55 174.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 88.2 tttt -62.71 -38.34 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.5 mm-40 -54.04 -45.37 71.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.883 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.656 ' HB ' HD21 ' A' ' 998' ' ' LEU . 1.9 t -71.71 -22.61 21.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.022 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.623 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.62 -45.79 34.37 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.109 -178.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.03 -21.61 66.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.826 0.346 . . . . 0.0 110.483 171.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 958' ' ' VAL . . . -62.34 -56.91 13.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.995 178.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 991' ' ' LEU . 8.3 tt -70.66 -27.26 63.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.195 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -54.51 45.12 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.022 170.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 24.8 m -53.89 -38.55 64.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.599 174.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.877 HD11 HG23 ' A' ' 929' ' ' VAL . 0.4 OUTLIER -64.33 -29.6 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.418 178.695 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.423 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 34.5 tp -63.97 -31.95 73.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.507 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.49 91.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.558 0.694 . . . . 0.0 110.045 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.744 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.9 m -62.99 -39.0 93.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.423 173.238 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 87.0 t -54.88 -31.73 25.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.286 174.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.531 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 0.9 OUTLIER -73.95 -23.19 59.46 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 176.62 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.637 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.4 mm-40 -67.62 -52.92 32.54 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 122.71 1.243 . . . . 0.0 109.001 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 9.6 p -66.8 -23.08 66.02 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.233 -1.348 . . . . 0.0 111.206 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.693 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 37.8 tp -55.76 -53.76 59.22 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-O 118.921 -0.561 . . . . 0.0 112.077 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 37.5 Cg_exo -61.09 -24.64 79.76 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.336 1.357 . . . . 0.0 111.246 170.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.691 HG12 ' HB ' ' A' ' 980' ' ' THR . 38.3 t -74.49 -13.94 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.334 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 1.015 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.3 tt -70.34 -53.16 10.72 Favored Pre-proline 0 C--O 1.234 0.27 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.407 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.529 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 33.9 Cg_exo -61.24 -25.5 80.71 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.178 1.252 . . . . 0.0 110.96 173.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.08 -64.97 0.77 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.22 174.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.833 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.4 m -163.46 -35.28 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -173.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 1.0 OUTLIER -61.47 -14.11 26.21 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -171.574 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 1.015 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 9.7 p-80 -50.15 -19.16 0.7 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -172.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.506 ' HE ' ' HA ' ' A' ' 982' ' ' ARG . 2.6 tpm_? -73.8 -52.72 12.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.58 176.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.925 ' HB3' HG13 ' A' 1038 ' ' VAL . 3.1 mp0 -77.05 -43.95 32.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.785 HD11 HG13 ' A' ' 969' ' ' VAL . 9.8 tp -56.97 -30.13 33.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.65 -174.183 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 10.5 mm-40 -73.02 -45.13 59.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.38 172.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.692 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 14.3 ptp -62.72 -54.41 39.61 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.648 -170.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.77 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -74.88 -35.55 62.3 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.14 -176.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.885 ' HA ' HD12 ' A' ' 991' ' ' LEU . 24.3 tp60 -59.59 -40.27 86.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.716 -176.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.721 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 69.1 mmtt -61.24 -42.35 98.46 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -65.75 -38.3 88.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.292 179.129 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.887 ' HB3' HD11 ' A' ' 962' ' ' LEU . 21.3 mt -61.8 -47.03 86.97 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.428 0.632 . . . . 0.0 109.888 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -57.81 -46.18 85.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.54 -177.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.7 p -70.81 -38.2 73.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.842 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 1.2 m-20 -91.42 -42.14 10.48 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -168.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.6 tm? -59.92 -40.45 88.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 171.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.48 69.63 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.97 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 9.8 pt-20 -68.71 -28.86 67.21 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.663 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.843 HD22 HD13 ' A' 1028 ' ' LEU . 1.1 tp -56.97 -49.56 75.32 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.523 175.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.639 ' O ' ' HG3' ' A' 1002 ' ' MET . 29.7 pt -73.55 -24.71 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 120.849 0.356 . . . . 0.0 111.471 -179.207 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.69 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.4 m-80 -87.12 -1.11 57.65 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 121.96 -0.463 . . . . 0.0 109.869 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1001 ' ' LYS . . . . . 1.0 ' HD2' ' HA ' ' A' 1021 ' ' MET . 5.5 ttpm? -82.99 -37.42 24.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.943 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -73.57 -37.64 65.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 173.151 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 53.8 tptt -56.63 -57.84 10.64 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.37 171.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.782 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 10.7 tp -55.29 -55.26 33.49 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.4 81.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 110.723 -177.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.7 -13.26 60.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.526 0.679 . . . . 0.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.7 tp-100 -79.79 -31.6 40.81 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.107 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.567 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 67.0 t80 . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.12 -176.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 N--CA 1.453 -0.3 0 CA-C-O 120.852 0.358 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.812 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 26.2 tt0 -60.55 -32.42 71.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.107 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.29 -43.77 22.68 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.262 169.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.782 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 7.2 m-30 -87.07 -7.36 58.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.083 0.468 . . . . 0.0 110.495 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.812 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 30.3 tptt -75.64 -26.41 57.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.654 169.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 67.7 mttm -72.35 -57.24 4.36 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -47.97 -35.56 11.02 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.471 169.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1021 ' ' MET . . . . . 1.0 ' HA ' ' HD2' ' A' 1001 ' ' LYS . 7.9 tpt -51.68 -48.69 63.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.263 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.54 -53.4 23.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.647 0.26 . . . . 0.0 110.851 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 15.2 m -59.95 -46.22 90.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.124 -174.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.853 ' HB3' ' HD3' ' A' 1001 ' ' LYS . . . -74.59 -31.97 62.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.689 0.28 . . . . 0.0 111.681 -173.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.638 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -75.47 -37.54 60.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.956 0.408 . . . . 0.0 110.451 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 26.5 t60 -70.38 -30.3 67.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.278 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -68.95 -34.76 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.376 176.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.843 HD13 HD22 ' A' ' 998' ' ' LEU . 0.6 OUTLIER -63.95 -42.47 97.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 122.145 0.974 . . . . 0.0 109.715 173.118 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.9 -33.56 64.75 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.349 176.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' 1027 ' ' ALA . 82.6 t -66.63 -33.77 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 172.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.737 ' HB2' HD23 ' A' ' 991' ' ' LEU . 1.9 p30 -72.36 -38.78 68.45 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.476 ' HB2' HD23 ' A' ' 932' ' ' LEU . . . -61.15 -44.72 96.87 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.692 171.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.651 ' O ' ' HG ' ' A' 1036 ' ' LEU . 60.0 tttm -63.76 -42.13 97.88 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.792 -176.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.599 ' O ' HG23 ' A' 1038 ' ' VAL . 66.1 t30 -73.2 -40.01 65.09 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.375 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.774 ' O ' HG12 ' A' 1039 ' ' ILE . 18.1 tp -73.76 -31.65 63.43 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.597 -177.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.84 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.3 pp -62.29 -37.02 83.92 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.481 ' N ' HD12 ' A' 1036 ' ' LEU . 29.2 t70 -75.67 -37.92 59.18 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.386 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.925 HG13 ' HB3' ' A' ' 983' ' ' GLU . 4.8 t -53.59 -59.07 2.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.98 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.81 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.5 pt -85.83 -24.73 6.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.153 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.458 ' HB2' ' CD1' ' A' ' 926' ' ' TYR . 19.7 t70 -61.08 -39.27 89.3 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.475 162.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.719 ' O ' ' HG2' ' A' 1045 ' ' LYS . 35.7 mt-30 -68.21 -35.08 77.42 Favored 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.393 171.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.629 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.98 -49.49 71.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.122 0.487 . . . . 0.0 110.717 174.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.84 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -47.4 -41.46 20.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.624 172.216 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.527 ' N ' ' HD3' ' A' 1043 ' ' ARG . 26.3 tp -79.97 -32.44 39.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.278 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.833 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 31.6 mmtp -63.13 -42.18 99.46 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.325 0.583 . . . . 0.0 109.973 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 25.6 ttt -69.12 -33.65 73.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.81 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.587 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 31.6 mm -69.53 -41.86 80.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.934 173.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 70.5 m -54.38 -28.03 40.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.615 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 2.2 tpm_? . . . . . 0 N--CA 1.449 -0.495 0 CA-C-O 120.742 0.306 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.403 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 38.3 m -123.59 46.14 2.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.684 -174.199 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 44.9 55.95 5.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.881 0.872 . . . . 0.0 112.934 173.491 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.612 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 23.8 t0 -47.8 -175.05 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.717 0 O-C-N 125.399 1.687 . . . . 0.0 111.845 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.491 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.2 tmtm? -37.0 -21.02 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.12 0.968 . . . . 0.0 112.874 -179.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.887 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 6.9 m -59.69 -51.44 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 O-C-N 122.144 -0.348 . . . . 0.0 111.299 173.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 27.4 t80 -75.63 -31.89 60.03 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -173.605 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.76 -58.07 7.23 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.874 -1.512 . . . . 0.0 111.651 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -70.6 -30.43 67.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.123 -173.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.673 HG22 HD11 ' A' ' 965' ' ' LEU . 61.2 t -66.19 -41.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.973 -0.691 . . . . 0.0 109.884 175.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.686 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 67.3 m -60.19 -35.86 76.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 169.272 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -59.52 -33.96 79.1 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.519 174.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.709 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.3 tt -63.7 -45.9 87.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.048 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.8 t -57.09 -42.54 79.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.915 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.686 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -63.71 -40.85 97.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.418 178.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.717 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.16 -26.55 42.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.959 -177.183 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' A' ' 939' ' ' MET . 15.0 p -79.01 -14.53 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.697 0.761 . . . . 0.0 109.128 172.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 24.4 mm -69.83 -31.43 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 167.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.568 ' HG3' ' HA ' ' A' ' 935' ' ' ALA . 36.2 mt-10 -61.27 -39.05 88.97 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.939 174.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.749 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 43.6 ttp -51.37 -47.06 62.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.334 172.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.621 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.9 t -71.9 -39.18 69.74 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.048 178.17 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 46.7 m -71.71 -50.88 26.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.159 0.504 . . . . 0.0 110.564 -169.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.631 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -82.98 -11.48 58.1 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.566 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -77.17 -45.79 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.212 0.46 . . . . 0.0 111.378 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -59.05 -46.81 99.42 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -173.349 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.609 ' HD3' ' HG3' ' A' ' 944' ' ' GLN . 79.2 Cg_endo -87.96 16.08 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.438 1.425 . . . . 0.0 113.545 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -125.72 154.26 73.15 Favored Pre-proline 0 C--N 1.328 -0.364 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.39 175.27 10.91 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 123.157 2.571 . . . . 0.0 111.821 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.966 ' HB3' HE21 ' A' 1006 ' ' GLN . 88.7 Cg_exo -50.24 -35.39 43.22 Favored 'Trans proline' 0 C--O 1.248 0.998 0 C-N-CA 123.118 2.545 . . . . 0.0 113.121 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -55.18 -25.27 31.45 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.857 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.696 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 53.3 mm-40 -106.94 -3.16 20.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.732 ' O ' ' HG3' ' A' ' 954' ' ' MET . 9.7 m-30 -61.31 -47.31 86.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 173.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.928 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.58 -44.01 12.2 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.876 177.019 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.928 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.5 Cg_exo -55.02 -29.72 66.34 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.805 1.67 . . . . 0.0 115.239 171.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 0.0 OUTLIER -72.95 -30.69 64.05 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.968 0.889 . . . . 0.0 109.644 178.389 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.784 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.6 OUTLIER -71.37 -26.2 26.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.003 174.455 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.651 ' HE3' ' HA ' ' A' ' 953' ' ' PRO . 8.6 mtmp? -58.15 -38.53 76.76 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.438 175.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' A' ' 957' ' ' GLU . 1.1 mm-40 -55.59 -45.98 77.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.711 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 2.2 t -65.42 -32.77 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.002 0.43 . . . . 0.0 110.788 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.79 -41.67 97.46 Favored Glycine 0 C--O 1.228 -0.232 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.775 177.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 62.6 tp -68.91 -33.47 73.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.242 0.544 . . . . 0.0 109.653 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.717 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -53.64 -57.07 12.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.766 177.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.953 HD22 ' HG ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -74.68 -21.13 59.57 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.578 -179.497 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -53.84 13.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.831 0.348 . . . . 0.0 110.322 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 7.0 m -58.22 -27.81 64.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.907 0.861 . . . . 0.0 109.488 173.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.673 HD11 HG22 ' A' ' 929' ' ' VAL . 17.4 tp -70.76 -37.27 73.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.889 178.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -51.01 -33.39 24.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.882 172.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -62.5 -48.84 77.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.798 0.332 . . . . 0.0 110.413 173.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.6 m -58.35 -46.1 86.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.306 173.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.794 HG13 HD11 ' A' ' 984' ' ' ILE . 96.6 t -52.43 -30.25 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.968 175.011 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.4 t70 -70.98 -29.06 64.94 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.289 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.623 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.5 mm-40 -65.57 -57.04 9.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.53 1.157 . . . . 0.0 109.036 172.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.492 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 53.0 p -58.5 -22.98 56.86 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.0 -1.0 . . . . 0.0 113.065 174.123 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.668 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 43.0 tp -56.83 -54.24 56.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.556 -179.033 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.668 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 52.3 Cg_exo -57.91 -23.71 60.95 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 121.6 1.533 . . . . 0.0 111.648 168.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.58 HG12 ' HB ' ' A' ' 980' ' ' THR . 44.0 t -74.89 -16.22 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.815 175.238 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 984' ' ' ILE . 1.0 OUTLIER -69.01 -48.08 28.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 118.973 -0.537 . . . . 0.0 111.641 176.688 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.528 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 39.9 Cg_exo -60.5 -26.51 82.96 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 121.156 1.237 . . . . 0.0 111.103 170.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 978' ' ' ALA . . . . . 0.631 ' HA ' ' OE1' ' A' 1049 ' ' GLN . . . -70.42 -66.6 0.58 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.803 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.832 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.0 m -165.46 -27.27 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -174.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.663 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 2.8 t -65.13 -12.81 54.97 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -172.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.551 ' CD2' ' HG3' ' A' ' 985' ' ' GLU . 3.7 t60 -45.8 -44.5 14.11 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 122.761 0.424 . . . . 0.0 111.621 -169.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -55.18 -53.53 54.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.038 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.0 OUTLIER -75.2 -43.45 51.88 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.794 HD11 HG13 ' A' ' 969' ' ' VAL . 11.3 tp -62.64 -26.62 41.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.297 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.551 ' HG3' ' CD2' ' A' ' 981' ' ' HIS . 1.3 mm-40 -74.08 -38.32 63.93 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.366 171.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 12.1 ptp -66.19 -62.44 1.48 Allowed 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.175 -174.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.705 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.23 -36.61 39.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -173.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.673 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.5 OUTLIER -69.47 -43.14 73.81 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.56 -175.064 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -66.36 -27.66 68.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.511 0.672 . . . . 0.0 109.244 173.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.559 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.8 tp -72.01 -39.92 68.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.494 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.852 HD11 HD22 ' A' 1035 ' ' LEU . 29.1 mt -59.76 -61.14 2.84 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.588 178.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -47.17 -37.8 10.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.113 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 71.0 m -67.43 -57.57 6.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.661 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.603 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 3.7 m-20 -93.66 -15.99 24.75 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.953 ' HG ' HD22 ' A' ' 962' ' ' LEU . 2.5 tm? -61.22 -50.6 72.41 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.626 1.103 . . . . 0.0 108.338 163.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.775 ' O ' ' HB3' ' A' 1000 ' ' ASN . . . -52.9 -30.73 35.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.544 172.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.71 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.8 tp10 -64.32 -45.24 88.75 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.551 HD21 ' O ' ' A' 1024 ' ' ALA . 4.1 mm? -77.54 -50.39 12.69 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.51 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.784 ' HA ' HG11 ' A' ' 955' ' ' VAL . 15.6 tt -57.0 -21.03 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 121.696 0.76 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.775 ' HB3' ' O ' ' A' ' 996' ' ' ALA . 0.6 OUTLIER -109.44 -22.19 12.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.578 -173.792 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.71 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 9.0 tptm -84.48 -36.45 22.26 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 123.126 0.266 . . . . 0.0 111.029 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 0.3 OUTLIER -78.69 -36.07 44.13 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.2 ttpt -58.73 -37.59 76.5 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 167.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.707 ' HB2' ' O ' ' A' 1000 ' ' ASN . 8.4 tt -68.85 -50.13 52.49 Favored 'General case' 0 C--O 1.214 -0.776 0 O-C-N 123.774 0.671 . . . . 0.0 110.295 -176.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' 1017 ' ' TYR . . . -55.55 -46.39 77.13 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.804 0.811 . . . . 0.0 109.959 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.966 HE21 ' HB3' ' A' ' 948' ' ' PRO . 0.9 OUTLIER -76.19 -13.54 60.18 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.777 -178.707 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -95.96 -40.42 9.29 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.412 0.625 . . . . 0.0 111.593 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 51.3 t80 . . . . . 0 C--N 1.315 -0.905 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.803 -176.436 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.555 ' NE2' ' HB1' ' A' 1005 ' ' ALA . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.104 0 CA-C-O 120.813 0.34 . . . . 0.0 110.521 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -59.17 -25.79 64.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.004 -172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -54.52 -58.5 7.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.35 0.595 . . . . 0.0 109.847 173.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.604 ' HB2' ' HA ' ' A' 1005 ' ' ALA . 0.1 OUTLIER -55.0 -33.14 62.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.539 177.759 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 58.2 tttm -71.38 -45.47 62.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.904 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.62 -27.97 64.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.857 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.91 -44.08 94.49 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 170.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' A' 1002 ' ' MET . 1.7 tmt? -61.82 -42.08 98.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.581 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.91 -39.04 76.97 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.162 0.506 . . . . 0.0 110.784 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 31.4 m -69.57 -46.74 65.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.149 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.551 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -60.67 -36.09 77.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.543 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.488 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -59.04 -35.8 73.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.086 0.47 . . . . 0.0 110.754 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.587 ' O ' HG23 ' A' 1030 ' ' VAL . 16.2 t-160 -67.31 -31.7 72.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.78 177.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.501 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -72.35 -55.74 6.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.062 -178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 995' ' ' LEU . 24.5 tp -58.74 -35.85 73.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.046 0.451 . . . . 0.0 111.531 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.41 -36.93 66.99 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.879 0.371 . . . . 0.0 111.548 170.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' 1026 ' ' HIS . 82.6 t -64.14 -36.18 76.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 175.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.603 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 11.0 m-20 -60.59 -44.56 96.11 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.982 0.42 . . . . 0.0 110.486 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.538 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -59.52 -54.0 51.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.514 174.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -53.37 -38.29 63.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' 1038 ' ' VAL . 54.0 t30 -71.58 -54.02 11.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.186 -178.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.852 HD22 HD11 ' A' ' 991' ' ' LEU . 15.0 tp -57.52 -33.19 67.81 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.885 179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.581 ' N ' HG11 ' A' ' 929' ' ' VAL . 38.7 tp -52.62 -47.29 67.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.857 0.837 . . . . 0.0 109.842 176.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.3 t70 -68.51 -42.15 78.94 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.355 174.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.038 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.0 t -52.97 -61.91 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.459 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.781 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.887 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -82.45 -30.2 9.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.777 ' H ' HD12 ' A' 1039 ' ' ILE . 44.1 t0 -56.88 -37.49 71.45 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 165.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' 1045 ' ' LYS . 2.7 mp0 -73.15 -36.56 66.68 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 114.536 -1.211 . . . . 0.0 109.63 172.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.664 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.49 -52.44 59.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.24 0.543 . . . . 0.0 111.232 176.234 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.936 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 0.3 OUTLIER -58.83 -31.0 68.08 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.94 179.198 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.651 HD12 ' HB3' ' A' ' 920' ' ' ARG . 11.1 mp -77.88 -31.85 51.59 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.943 -0.117 . . . . 0.0 111.22 171.193 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.832 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 32.9 mmtp -59.87 -36.93 77.94 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.812 0.815 . . . . 0.0 108.915 175.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 42.2 ttp -69.22 -36.81 77.61 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.473 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' 1043 ' ' ARG . 48.6 mm -64.69 -42.45 95.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.539 172.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 37.3 m -55.98 -46.61 78.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.841 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1049 ' ' GLN . . . . . 0.631 ' OE1' ' HA ' ' A' ' 978' ' ' ALA . 24.9 tt0 . . . . . 0 N--CA 1.461 0.118 0 CA-C-O 120.575 0.226 . . . . 0.0 111.581 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.978 ' HG3' ' HB2' ' A' 1043 ' ' ARG . 3.4 mmp_? . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 32.4 t 63.19 16.52 9.46 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -166.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 923' ' ' ASP . 2.3 m-20 55.65 72.33 0.49 Allowed 'General case' 0 CA--C 1.498 -1.047 0 CA-C-N 114.326 -1.307 . . . . 0.0 109.602 -174.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -46.63 -174.75 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.532 0 O-C-N 126.299 2.249 . . . . 0.0 113.074 -168.676 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.601 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 3.1 tmtm? -46.9 -8.05 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.731 0.812 . . . . 0.0 112.307 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.735 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 0.0 OUTLIER -72.26 -49.76 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 C-N-CA 122.704 0.402 . . . . 0.0 110.896 174.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 14.9 t80 -73.3 -25.81 60.81 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.111 0.958 . . . . 0.0 108.416 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 930' ' ' THR . 97.1 mt-10 -73.54 -57.4 4.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.333 -177.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -66.49 -32.79 74.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.491 -171.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 1.079 HG11 ' HA ' ' A' 1036 ' ' LEU . 12.2 p -67.38 -40.97 85.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.789 177.035 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.59 HG22 ' HD2' ' A' ' 934' ' ' LYS . 59.6 m -53.8 -31.99 51.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.821 0.343 . . . . 0.0 110.694 166.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 931' ' ' GLY . . . . . 0.508 ' HA2' ' HB2' ' A' ' 934' ' ' LYS . . . -66.99 -31.97 79.52 Favored Glycine 0 C--O 1.227 -0.307 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 176.152 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 1.033 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.57 -51.06 70.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 173.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.5 t -60.87 -31.37 49.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.275 0.56 . . . . 0.0 110.906 174.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 930' ' ' THR . 0.0 OUTLIER -72.13 -43.53 64.55 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.008 -178.572 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 1.025 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.83 -25.26 56.11 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 122.201 -0.312 . . . . 0.0 111.349 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.623 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -75.87 -13.05 14.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 119.636 -0.825 . . . . 0.0 109.644 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 37.4 mm -71.11 -31.04 43.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 168.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 12.2 mm-40 -57.88 -40.71 80.88 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 171.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.467 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 47.6 ttp -56.47 -45.22 81.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.572 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.48 ' O ' HG22 ' A' ' 943' ' ' ILE . 16.2 p -73.19 -31.54 64.27 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.626 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 8.0 p -78.5 -40.8 34.23 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -177.292 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.503 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 4.4 mmtp -52.37 -47.16 66.34 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.47 174.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.603 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 16.5 tt -70.67 -22.35 23.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.522 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.828 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 16.2 mm100 -55.68 -61.98 5.33 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.579 178.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 12.2 Cg_endo -92.92 -31.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.833 1.689 . . . . 0.0 114.086 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -83.82 150.41 58.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.218 0.532 . . . . 0.0 112.371 -169.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.587 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 72.6 Cg_endo -83.87 -177.83 3.28 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.371 2.714 . . . . 0.0 113.156 -177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.587 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 4.8 Cg_endo -49.3 -36.57 38.14 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 124.245 3.297 . . . . 0.0 113.96 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -55.06 -20.17 8.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.664 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.626 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 61.4 mm-40 -107.71 -4.96 17.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.591 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.9 m-30 -57.61 -42.19 82.75 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.49 -46.87 3.3 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 119.181 -1.007 . . . . 0.0 112.531 177.347 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 78.2 Cg_exo -57.49 -29.45 84.78 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.562 1.508 . . . . 0.0 114.676 171.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.603 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 19.6 ptp -73.81 -31.88 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.446 0.641 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -72.29 -25.6 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.325 174.111 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 17.9 tppt? -58.57 -41.68 86.22 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.99 -45.82 68.01 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.884 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -66.69 -29.71 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.022 178.119 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.545 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -67.4 -41.69 90.57 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.91 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.72 -40.6 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 109.901 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 1.033 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -48.45 -57.48 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 173.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.756 ' HB2' HD13 ' A' ' 995' ' ' LEU . 5.2 tt -70.52 -28.9 65.3 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 119.162 -1.015 . . . . 0.0 111.651 177.215 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -56.8 -57.24 13.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.701 0.286 . . . . 0.0 110.746 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 1.7 p -58.57 -44.55 89.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.18 0.514 . . . . 0.0 110.365 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 57.1 tp -51.1 -41.58 60.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.133 175.187 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 73.8 mt -54.82 -36.52 65.07 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.93 93.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.972 0.415 . . . . 0.0 109.978 175.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.684 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -63.85 -38.94 92.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.016 173.044 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 82.0 t -54.79 -31.9 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 O-C-N 122.235 -0.291 . . . . 0.0 110.802 172.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.509 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 2.7 m-20 -73.03 -22.48 60.63 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.757 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.5 mm-40 -74.23 -44.35 53.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.176 0.988 . . . . 0.0 108.638 171.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.503 ' OG ' HG21 ' A' ' 980' ' ' THR . 32.8 t -69.2 -24.13 63.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.892 177.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.719 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 55.7 tp -59.91 -50.68 85.33 Favored Pre-proline 0 C--O 1.218 -0.58 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.505 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 11.5 Cg_endo -61.12 -26.17 82.22 Favored 'Trans proline' 0 C--N 1.355 0.908 0 CA-C-N 121.424 1.544 . . . . 0.0 110.927 170.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.9 t -77.15 -11.08 13.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.222 174.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 1.9 tt -69.16 -53.23 14.07 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.62 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.462 ' N ' HD23 ' A' ' 976' ' ' LEU . 45.0 Cg_endo -69.44 -19.46 37.61 Favored 'Trans proline' 0 C--N 1.358 1.048 0 CA-C-N 120.457 1.199 . . . . 0.0 110.933 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -67.97 -55.31 13.2 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.694 172.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.703 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 31.1 m -166.11 -35.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -175.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.789 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.4 m -64.17 -18.43 64.47 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -168.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.772 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 11.6 t-160 -48.81 -26.43 2.39 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -172.172 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -72.2 -56.1 6.12 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.383 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.743 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.11 -42.65 62.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.626 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.789 ' HB ' HG22 ' A' ' 980' ' ' THR . 12.0 tt -58.76 -30.94 43.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.195 -174.015 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -72.68 -37.73 67.8 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.285 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.609 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 13.6 ptp -67.23 -59.06 3.74 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.629 -176.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.825 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -68.41 -45.57 72.28 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 1.128 ' HA ' HD12 ' A' ' 991' ' ' LEU . 34.6 tt0 -58.23 -44.32 88.19 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.616 -175.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -61.6 -33.88 74.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.424 0.63 . . . . 0.0 109.933 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.65 -42.55 61.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.469 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.128 HD12 ' HA ' ' A' ' 988' ' ' GLN . 14.5 mt -53.43 -58.13 8.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 174.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -45.65 -48.15 14.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.184 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 4.5 p -73.06 -47.62 43.07 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.011 -176.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.482 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.1 m-20 -82.09 -38.67 24.51 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -170.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -56.26 -60.21 3.83 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.623 0.647 . . . . 0.0 109.798 170.954 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.45 -23.46 38.96 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.899 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 993' ' ' SER . 20.5 tt0 -70.56 -43.24 69.89 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.297 -0.961 . . . . 0.0 108.554 177.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.634 ' HA ' ' HB1' ' A' 1024 ' ' ALA . 0.3 OUTLIER -60.84 -47.54 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.628 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.7 mt -55.63 -68.55 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.381 -179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.824 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.1 OUTLIER -54.05 -18.91 4.06 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 114.395 -1.275 . . . . 0.0 113.108 177.897 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.64 ' HG3' ' HB2' ' A' 1024 ' ' ALA . 24.6 mmtp -85.26 -37.69 19.74 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.873 0.761 . . . . 0.0 111.395 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 998' ' ' LEU . 57.2 mtp -79.18 -34.78 42.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.652 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.9 tttm -63.54 -40.94 98.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 113.568 -1.651 . . . . 0.0 108.699 170.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.824 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.3 tp -60.77 -46.82 88.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.041 173.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -58.97 -45.18 91.18 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.6 0.714 . . . . 0.0 109.989 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -77.12 -6.58 53.42 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.261 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp-100 -91.09 -22.46 20.71 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.319 175.081 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 64.6 t80 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.48 -176.777 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.54 ' OE1' ' HB2' ' A' 1018 ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.713 0.292 . . . . 0.0 110.698 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.542 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 62.8 tt0 -53.59 -36.08 61.56 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.183 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.37 -59.3 4.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.116 0.484 . . . . 0.0 111.44 175.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.687 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.1 m-30 -62.27 -35.74 79.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.858 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.737 ' O ' ' HG2' ' A' 1021 ' ' MET . 86.2 tttt -55.63 -39.35 70.7 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.575 172.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.431 ' HD2' HD12 ' A' 1022 ' ' LEU . 26.5 tptp -68.29 -44.19 76.01 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.147 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -57.73 -33.08 68.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.96 174.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.737 ' HG2' ' O ' ' A' 1018 ' ' LYS . 9.0 ptt? -75.34 -25.66 57.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' 1018 ' ' LYS . 94.1 mt -71.15 -38.07 72.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.009 0.433 . . . . 0.0 109.857 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 98.9 m -59.76 -41.39 90.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.994 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.64 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -64.79 -38.39 90.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.159 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -62.6 -38.62 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.457 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.538 ' O ' HG23 ' A' 1030 ' ' VAL . 1.7 t-80 -68.78 -39.38 80.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.47 174.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.482 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -63.77 -51.64 63.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.782 -177.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.2 OUTLIER -60.79 -43.87 97.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.868 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.536 ' N ' HD23 ' A' 1028 ' ' LEU . . . -53.6 -28.3 31.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.819 173.547 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 1026 ' ' HIS . 88.5 t -72.4 -45.71 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 121.221 -0.192 . . . . 0.0 110.736 174.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.769 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.3 p30 -64.49 -47.27 79.58 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.632 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' 1036 ' ' LEU . . . -52.96 -29.08 26.82 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.281 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' 1036 ' ' LEU . 35.7 ttpt -83.49 -48.77 9.94 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.451 0.644 . . . . 0.0 109.308 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.539 ' O ' HG23 ' A' 1038 ' ' VAL . 2.8 t-20 -61.54 -47.97 83.13 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.349 -176.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.864 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 12.6 tp -67.75 -33.22 74.42 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.798 -177.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1036 ' ' LEU . . . . . 1.079 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -58.28 -27.43 64.03 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.543 0.687 . . . . 0.0 109.66 177.535 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.0 t0 -92.09 -34.49 14.35 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.636 -1.165 . . . . 0.0 108.694 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.864 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 21.7 t -63.62 -53.32 46.42 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 CA-C-N 115.423 -0.808 . . . . 0.0 113.108 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.794 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.1 pt -82.01 -30.49 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 122.432 -0.168 . . . . 0.0 111.228 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.913 ' O ' ' HD3' ' A' 1043 ' ' ARG . 19.9 t0 -53.78 -29.78 41.75 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 118.532 -1.267 . . . . 0.0 110.662 157.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' 1037 ' ' ASP . 58.9 mt-30 -81.46 -28.73 34.01 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 120.372 -1.455 . . . . 0.0 109.742 169.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.18 -52.94 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.823 0.344 . . . . 0.0 110.843 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.978 ' HB2' ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -62.34 -33.14 74.12 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 177.118 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.512 ' O ' ' HB ' ' A' 1047 ' ' ILE . 3.7 tp -79.08 -22.4 45.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.53 -0.731 . . . . 0.0 110.493 175.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.703 ' HG3' ' HB3' ' A' ' 979' ' ' SER . 13.7 mptt -62.75 -37.0 84.86 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 166.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.434 ' HB3' ' O ' ' A' 1043 ' ' ARG . 22.9 ttt -67.96 -36.11 79.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.373 174.222 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' A' 1044 ' ' LEU . 27.9 mm -60.65 -43.98 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.91 172.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.591 ' HB3' ' O ' ' A' 1045 ' ' LYS . 35.9 t -47.75 -38.06 14.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.492 174.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 . . . . . 0 C--N 1.328 -0.33 0 CA-C-O 120.629 0.252 . . . . 0.0 111.295 178.609 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.93 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 7.4 tpt180 . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 8.1 p -80.45 39.22 0.45 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -176.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.698 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.4 OUTLIER 47.93 56.81 6.73 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.047 0.939 . . . . 0.0 112.339 172.869 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 925' ' ' VAL . 5.0 p-10 -47.24 -171.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 O-C-N 125.946 2.029 . . . . 0.0 113.632 -175.336 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.615 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.3 tmtp? -42.04 -8.54 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.568 1.147 . . . . 0.0 113.403 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 1.04 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 2.7 m -73.4 -53.81 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 O-C-N 122.078 -0.389 . . . . 0.0 110.9 174.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.522 ' HD1' ' HB2' ' A' 1040 ' ' ASP . 62.3 t80 -76.69 -28.81 56.05 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.055 0.931 . . . . 0.0 108.829 -172.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 930' ' ' THR . 5.3 mm-40 -74.91 -52.27 11.67 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.522 -177.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.615 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 58.1 t30 -73.35 -31.04 63.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -173.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.971 HG11 HD11 ' A' 1039 ' ' ILE . 11.5 p -65.03 -42.22 94.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.596 175.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.675 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 73.6 m -52.0 -30.48 25.38 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-O 120.718 0.294 . . . . 0.0 110.495 166.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -60.83 -31.61 76.47 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.196 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.868 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.3 tt -66.92 -41.76 86.53 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 937' ' ' ILE . 40.1 t -63.89 -32.99 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.203 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -73.84 -31.18 63.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.37 0.605 . . . . 0.0 109.434 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.59 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -77.98 -30.39 50.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.141 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 933' ' ' VAL . 11.5 p -79.15 -12.73 13.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 175.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -70.1 -38.73 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 165.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.525 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 43.5 mt-10 -61.26 -44.86 96.56 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.416 172.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.586 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 25.2 ttt -56.88 -45.56 82.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.703 176.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 13.7 t -66.45 -34.03 77.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.61 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.657 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 47.6 m -76.46 -28.59 56.59 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.081 0.943 . . . . 0.0 109.245 -177.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.577 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 20.4 mmtm -69.7 -62.31 1.43 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.222 176.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.829 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -59.62 -31.78 47.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.401 -167.689 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.731 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 50.6 mt-30 -73.89 -64.24 0.78 Allowed Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.337 -175.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.8 Cg_endo -90.29 14.73 2.01 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.151 1.234 . . . . 0.0 114.675 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -127.51 153.61 77.43 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 121.875 -0.516 . . . . 0.0 111.164 175.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.511 ' HB2' ' OE1' ' A' ' 949' ' ' GLU . 4.2 Cg_exo -81.02 176.22 9.12 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.637 2.891 . . . . 0.0 112.629 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.709 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 81.6 Cg_exo -50.97 -32.26 37.6 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.755 2.97 . . . . 0.0 114.792 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.511 ' OE1' ' HB2' ' A' ' 947' ' ' PRO . 1.8 pm0 -55.65 -32.17 62.98 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.904 175.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.592 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER -91.97 -1.91 57.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 176.549 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.749 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.6 m-30 -65.83 -32.89 74.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.992 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.17 -51.61 2.67 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 119.129 -1.028 . . . . 0.0 112.046 173.204 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.992 ' HD3' HG13 ' A' ' 952' ' ' VAL . 81.1 Cg_exo -52.99 -30.3 48.17 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.167 1.911 . . . . 0.0 114.897 170.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.829 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.2 ptt? -65.25 -42.29 93.46 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.633 0.73 . . . . 0.0 109.739 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.573 ' HB ' ' HB3' ' A' 1002 ' ' MET . 79.0 t -73.62 -26.3 21.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.913 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.6 OUTLIER -53.32 -45.75 69.15 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.872 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.8 mm-40 -55.13 -48.59 73.45 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.981 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 4.1 m -74.01 -28.34 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.494 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.49 -43.53 44.56 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.646 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.458 HD23 ' HD3' ' A' ' 956' ' ' LYS . 4.3 mm? -62.33 -38.74 90.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.185 -0.508 . . . . 0.0 109.674 172.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.868 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -50.18 -55.85 13.46 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 171.125 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 2.4 tm? -66.43 -34.86 78.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.111 0.414 . . . . 0.0 110.621 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -56.84 -53.35 58.91 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 122.109 -0.369 . . . . 0.0 111.254 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.442 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 26.3 m -64.35 -40.15 95.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.301 0.572 . . . . 0.0 110.126 177.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 23.5 tp -53.11 -39.69 63.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.562 172.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.81 -27.7 63.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -65.11 -42.49 93.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 171.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.629 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.3 m -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.729 171.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -54.49 -30.62 21.89 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.446 174.692 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.642 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 29.5 t70 -75.89 -26.87 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.512 0.196 . . . . 0.0 111.161 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.4 mm-40 -70.77 -48.65 53.21 Favored 'General case' 0 C--O 1.247 0.921 0 CA-C-O 122.707 1.242 . . . . 0.0 107.943 173.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.541 ' OG ' HG21 ' A' ' 980' ' ' THR . 35.3 t -69.58 -22.98 63.48 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 114.361 -1.291 . . . . 0.0 110.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 1.087 ' HA ' HD13 ' A' ' 976' ' ' LEU . 1.7 tm? -54.43 -55.29 38.98 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.593 -177.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.642 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.3 Cg_endo -58.05 -26.8 77.01 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 120.749 1.303 . . . . 0.0 110.682 170.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.0 -16.28 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.62 175.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 1.087 HD13 ' HA ' ' A' ' 973' ' ' LEU . 10.8 mp -58.87 -61.37 7.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-O 118.983 -0.532 . . . . 0.0 110.553 173.112 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.628 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 50.5 Cg_exo -57.05 -31.31 89.82 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 121.68 1.587 . . . . 0.0 111.539 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 978' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' 1049 ' ' GLN . . . -61.02 -54.78 40.7 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.77 174.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.818 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -171.11 -37.8 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -176.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.653 HG22 ' HB ' ' A' ' 984' ' ' ILE . 25.2 m -59.27 -22.09 60.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -170.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.589 ' HA ' HG22 ' A' ' 984' ' ' ILE . 0.1 OUTLIER -52.66 -20.48 3.12 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -173.085 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -70.51 -55.94 7.75 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.738 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.04 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -75.23 -42.87 54.37 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.98 HD13 HD11 ' A' ' 976' ' ' LEU . 18.6 tt -60.85 -36.4 71.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 119.025 -1.07 . . . . 0.0 109.047 -173.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -59.42 -40.63 87.32 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.969 -0.693 . . . . 0.0 111.488 171.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.613 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 8.1 ptp -68.07 -63.25 1.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.588 -177.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.741 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.12 -33.47 50.48 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 24.4 tm0? -71.51 -41.43 69.24 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.383 0.992 . . . . 0.0 110.0 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -71.14 -23.03 62.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.625 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.3 tp -70.11 -48.79 56.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.092 175.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 79.7 mt -53.6 -43.29 68.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.013 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -50.57 -39.13 48.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.539 173.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 35.8 t -77.34 -50.32 13.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.443 ' CG ' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p30 -72.59 -39.66 67.18 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -174.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.494 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.0 tm? -56.88 -48.15 78.84 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 171.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.781 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -52.12 -26.48 11.35 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 171.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 5.2 mm-40 -79.08 -34.91 43.21 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.525 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.875 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 10.3 mp -80.22 -32.09 38.51 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.857 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.781 HG12 ' HA ' ' A' ' 996' ' ' ALA . 44.3 pt -68.94 -20.42 24.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.779 175.234 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 1.6 p30 -95.99 -17.37 21.05 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.875 ' HB3' ' HA ' ' A' ' 998' ' ' LEU . 37.2 tptt -65.86 -40.77 91.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.152 0.501 . . . . 0.0 109.906 168.402 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.964 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.0 ptt? -78.29 -34.42 48.82 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.869 ' O ' ' HB2' ' A' 1007 ' ' GLN . 27.1 tttp -61.42 -56.81 16.1 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.044 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' 1004 ' ' LEU . 14.0 mt -66.4 -48.32 70.48 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.884 -172.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.77 -47.91 84.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.41 0.624 . . . . 0.0 110.481 -178.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.44 59.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.528 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.869 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.9 tp-100 -80.78 -43.14 20.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.3 0.571 . . . . 0.0 110.062 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.639 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 14.5 m-85 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.375 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.78 -34.71 59.94 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' 1017 ' ' TYR . 0.4 OUTLIER -49.49 -59.56 3.64 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.52 1.152 . . . . 0.0 110.236 171.43 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HD2' ' A' 1008 ' ' TYR . 86.8 m-85 -69.04 -29.95 68.21 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.031 -1.895 . . . . 0.0 110.928 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.504 ' HE3' HD11 ' A' ' 943' ' ' ILE . 81.4 tttt -58.15 -46.91 84.86 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.253 165.118 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -76.72 -59.59 2.71 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.046 0.451 . . . . 0.0 112.058 -172.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -57.81 -46.31 84.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.19 -176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.705 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 20.4 mmt -74.73 -17.66 60.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.344 -177.204 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' 1018 ' ' LYS . 34.6 tp -70.92 -30.87 67.32 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 22.4 m -65.39 -38.66 90.67 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.664 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -67.35 -36.62 81.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.351 174.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.758 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -63.9 -34.84 78.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.869 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.459 ' O ' HG23 ' A' 1030 ' ' VAL . 40.2 t-80 -68.47 -31.32 70.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.719 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -61.28 -54.49 43.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 998' ' ' LEU . 0.3 OUTLIER -56.21 -48.35 76.6 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.049 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.53 ' N ' HD23 ' A' 1028 ' ' LEU . . . -54.2 -33.11 57.44 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.466 ' O ' ' HB3' ' A' 1033 ' ' LYS . 85.1 t -84.13 -38.61 14.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.994 0.426 . . . . 0.0 111.027 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.536 ' OD1' HD21 ' A' ' 990' ' ' LEU . 66.2 m-20 -72.7 -29.32 63.28 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.983 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.512 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -52.62 -55.2 24.07 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 161.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.653 ' O ' ' HB3' ' A' 1036 ' ' LEU . 5.0 tmmm? -52.31 -29.45 23.45 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 172.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' 1038 ' ' VAL . 2.4 t-20 -68.13 -48.32 65.72 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.41 -0.806 . . . . 0.0 109.193 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.812 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 10.3 tp -64.18 -32.49 74.08 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.88 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.964 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.0 tm? -48.65 -32.15 7.82 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.88 0.872 . . . . 0.0 109.781 173.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' 1041 ' ' GLN . 22.3 t70 -92.74 -35.96 13.17 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.821 178.004 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.04 HG13 ' HB3' ' A' ' 983' ' ' GLU . 38.1 t -55.92 -62.21 0.9 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.215 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1039 ' ' ILE . . . . . 1.04 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -75.94 -33.33 25.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.923 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.843 ' H ' HD12 ' A' 1039 ' ' ILE . 26.5 t70 -54.76 -31.37 58.55 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.47 162.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.821 ' HB3' ' HE2' ' A' 1045 ' ' LYS . 50.5 mt-30 -77.5 -33.76 54.32 Favored 'General case' 0 C--O 1.206 -1.232 0 C-N-CA 118.964 -1.094 . . . . 0.0 108.25 171.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.634 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.86 -53.07 60.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.571 0.544 . . . . 0.0 110.679 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.93 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.76 -42.79 17.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.404 172.072 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.486 ' N ' ' HD3' ' A' 1043 ' ' ARG . 60.3 tp -79.4 -28.94 41.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.644 0.259 . . . . 0.0 111.398 177.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.821 ' HE2' ' HB3' ' A' 1041 ' ' GLN . 73.0 mmtt -60.31 -43.85 95.97 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.859 0.838 . . . . 0.0 109.267 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 18.8 ttt -62.99 -36.33 83.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.347 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.875 HD11 ' HB2' ' A' ' 920' ' ' ARG . 39.3 mm -62.15 -49.96 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.509 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 39.1 t -52.35 -40.05 61.48 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.631 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1049 ' ' GLN . . . . . 0.412 ' HB2' ' HB1' ' A' ' 978' ' ' ALA . 48.7 tp60 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.421 0.629 . . . . 0.0 111.373 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 16.8 p -112.25 19.35 17.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.097 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.45 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.44 53.97 11.98 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.505 -174.227 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.62 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 29.8 t70 -47.33 -175.31 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 O-C-N 125.834 1.959 . . . . 0.0 112.268 -173.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.467 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.6 tmtp? -35.51 -24.09 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 124.294 1.038 . . . . 0.0 112.024 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.821 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.1 m -59.23 -52.41 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.297 175.059 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -76.96 -21.27 55.01 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 122.122 0.963 . . . . 0.0 108.975 -177.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 35.7 mt-10 -79.31 -54.59 5.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.087 -174.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.425 ' OD1' ' HE2' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.63 -32.54 68.08 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.812 -177.704 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 1.003 HG11 ' HA ' ' A' 1036 ' ' LEU . 9.8 p -63.71 -38.34 82.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.476 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.547 ' CG2' HD12 ' A' 1036 ' ' LEU . 7.7 p -70.17 -28.3 65.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.4 -30.59 65.01 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.335 171.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.997 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.2 tt -68.08 -48.73 64.74 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 937' ' ' ILE . 36.0 t -57.51 -44.63 85.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 110.343 174.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 0.0 OUTLIER -59.04 -32.18 69.52 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.043 176.598 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.7 -26.63 40.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.583 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.632 ' O ' ' HB3' ' A' ' 939' ' ' MET . 14.7 p -83.49 -12.56 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.035 171.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 933' ' ' VAL . 46.0 mm -73.83 -39.07 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 164.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.6 mm-40 -52.57 -33.8 47.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.314 169.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.97 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 32.5 ttm -60.03 -45.82 91.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.974 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.569 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 48.8 m -68.25 -30.05 69.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.173 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.697 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.6 m -76.49 -33.8 58.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.824 0.821 . . . . 0.0 109.008 -177.191 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.621 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 19.5 mmtt -60.09 -50.47 73.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.195 -1.366 . . . . 0.0 112.28 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.401 HD13 ' CE1' ' A' ' 951' ' ' TYR . 6.8 tp -69.67 -23.69 26.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.049 -176.222 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.733 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.9 mt-30 -52.68 -61.73 4.28 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.733 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 73.6 Cg_endo -99.62 10.0 0.72 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.783 1.656 . . . . 0.0 115.148 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.629 ' HB3' ' HG2' ' A' ' 950' ' ' GLU . . . -139.24 159.67 65.34 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 118.885 0.766 . . . . 0.0 112.844 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.7 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 1.5 Cg_endo -83.5 173.92 9.25 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.859 3.039 . . . . 0.0 111.569 174.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 91.4 Cg_exo -48.4 -16.29 0.66 Allowed 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 124.264 3.309 . . . . 0.0 115.277 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -54.43 -18.5 4.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.21 169.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.7 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.0 OUTLIER -95.4 -15.42 23.04 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.655 175.189 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 948' ' ' PRO . 5.8 m-30 -49.38 -44.14 44.69 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.566 0.698 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.125 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.1 OUTLIER -69.84 -56.66 7.31 Favored Pre-proline 0 CA--C 1.555 1.169 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.134 177.617 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.974 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.5 Cg_exo -55.71 -35.08 92.61 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.509 2.139 . . . . 0.0 114.964 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.97 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 24.6 ptt? -65.41 -42.18 92.83 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.798 -0.563 . . . . 0.0 110.091 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.676 HG13 ' HG ' ' A' ' 998' ' ' LEU . 74.7 t -67.41 -28.6 42.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.996 170.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.5 tmpt? -60.29 -40.15 89.44 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 33.5 mm-40 -54.37 -45.97 72.93 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.423 174.822 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 1.8 t -75.73 -29.6 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.19 -44.09 77.5 Favored Glycine 0 N--CA 1.455 -0.09 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.829 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.478 HD22 ' HE3' ' A' ' 956' ' ' LYS . 11.0 mp -64.52 -21.29 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 110.574 171.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.2 -53.05 59.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.565 177.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.698 ' HB3' HD22 ' A' ' 995' ' ' LEU . 2.7 tm? -72.51 -28.8 63.1 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.121 177.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.411 ' HB2' ' HA ' ' A' ' 960' ' ' LEU . 60.0 mtp180 -54.69 -59.59 4.51 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.756 -0.59 . . . . 0.0 111.717 170.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 17.2 p -55.87 -37.73 69.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.235 0.54 . . . . 0.0 110.559 175.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' 1035 ' ' LEU . 23.8 tp -65.85 -27.88 68.56 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.994 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 49.3 tp -64.71 -34.45 78.34 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.65 90.71 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.576 0.703 . . . . 0.0 109.714 173.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.821 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 4.1 m -66.97 -39.68 87.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.04 173.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.654 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 70.8 t -54.62 -37.24 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.497 174.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 35.0 t70 -71.8 -22.77 61.52 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 20.3 mm-40 -65.74 -52.93 47.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 123.187 1.47 . . . . 0.0 108.06 168.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.559 ' OG ' HG21 ' A' ' 980' ' ' THR . 42.3 t -66.06 -25.43 67.03 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.291 -1.777 . . . . 0.0 111.855 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 969' ' ' VAL . 53.7 mt -61.35 -51.01 80.88 Favored Pre-proline 0 C--O 1.214 -0.798 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.921 -177.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.564 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 57.2 Cg_exo -56.64 -30.05 82.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 121.567 1.595 . . . . 0.0 111.075 168.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 3.2 t -75.6 -13.36 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.827 176.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.668 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 4.9 tt -64.35 -55.47 30.36 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.564 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 51.9 Cg_exo -56.72 -32.26 90.52 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.61 1.54 . . . . 0.0 111.37 174.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.18 -65.05 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.012 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.1 m -157.99 -36.76 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.793 HG22 ' HB ' ' A' ' 984' ' ' ILE . 4.9 m -55.43 -18.48 7.04 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -174.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.668 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 16.1 p-80 -48.78 -20.19 0.45 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 79.7 mtt180 -78.11 -55.39 5.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.077 0.942 . . . . 0.0 110.154 175.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.853 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.71 -45.77 23.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.389 -175.023 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.793 ' HB ' HG22 ' A' ' 980' ' ' THR . 8.7 tp -56.78 -34.05 42.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.469 -172.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 0.0 OUTLIER -74.45 -34.5 63.19 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.165 179.279 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.0 ptp -60.75 -56.4 21.69 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 119.958 -0.697 . . . . 0.0 112.294 -174.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.575 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.62 -33.71 41.23 Favored 'General case' 0 C--O 1.209 -1.042 0 O-C-N 122.262 -0.274 . . . . 0.0 110.973 -176.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 1.092 ' HA ' HD12 ' A' ' 991' ' ' LEU . 48.0 tt0 -61.12 -46.09 92.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.099 0.475 . . . . 0.0 110.889 -176.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 989' ' ' LYS . 9.2 mmmm -62.6 -31.48 72.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.71 175.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.688 ' HG ' ' OD1' ' A' 1031 ' ' ASP . 5.7 tp -75.19 -32.9 61.35 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.653 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.092 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.2 mt -63.58 -48.44 77.39 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.199 0.523 . . . . 0.0 110.053 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -58.06 -38.27 75.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.451 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 4.6 t -60.75 -49.86 75.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.059 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.02 -27.82 10.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.678 -0.809 . . . . 0.0 113.103 -165.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.924 ' HA ' HD22 ' A' 1028 ' ' LEU . 5.7 tp -56.86 -48.03 79.06 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 167.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.412 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -58.09 -46.66 85.12 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.513 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.692 ' O ' ' HG2' ' A' 1001 ' ' LYS . 10.3 mm-40 -62.81 -36.65 83.87 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.241 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.676 ' HG ' HG13 ' A' ' 955' ' ' VAL . 47.0 tp -66.82 -33.4 75.53 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 995' ' ' LEU . 75.9 mt -61.53 -35.97 70.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.897 175.151 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.664 ' O ' ' HB2' ' A' 1004 ' ' LEU . 49.1 m-80 -89.22 -6.61 56.73 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.526 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 67.1 mmtt -86.58 -36.33 18.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 174.708 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.125 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -70.87 -38.12 73.09 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.458 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.799 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.0 tttm -60.37 -54.24 47.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.224 -1.353 . . . . 0.0 108.889 172.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.741 ' HG ' ' CD2' ' A' 1017 ' ' TYR . 14.9 tp -57.89 -48.22 80.49 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.53 90.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.336 0.589 . . . . 0.0 110.426 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -76.34 -12.12 60.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.565 0.697 . . . . 0.0 109.8 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.799 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -81.67 -28.08 33.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.07 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 56.6 t80 . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.63 -179.127 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.452 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 110.682 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.756 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.8 tt0 -56.13 -31.03 62.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.556 -171.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -51.35 -57.34 9.17 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.214 0.531 . . . . 0.0 110.531 171.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.741 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.0 m-30 -73.81 -23.52 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.703 178.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.756 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 62.2 tttp -64.43 -44.65 90.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.24 178.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' 1015 ' ' GLN . 97.3 mttt -59.53 -56.58 20.22 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.987 0.422 . . . . 0.0 109.946 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -50.89 -40.33 56.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.531 174.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.688 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 19.6 ttt -62.43 -52.21 64.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.4 tp -61.93 -35.24 77.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 40.1 m -63.76 -34.34 77.68 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.156 0.503 . . . . 0.0 110.811 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.687 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -79.7 -39.07 32.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.337 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -59.75 -43.85 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.144 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' 1030 ' ' VAL . 56.6 t60 -59.48 -36.24 75.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.379 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.4 65.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.924 HD22 ' HA ' ' A' ' 995' ' ' LEU . 5.0 tp -73.11 -32.0 64.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 178.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.95 -49.87 75.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.17 173.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' 1026 ' ' HIS . 99.2 t -69.17 -19.95 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 121.664 0.745 . . . . 0.0 110.622 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.811 ' OD2' ' HA ' ' A' ' 991' ' ' LEU . 0.6 OUTLIER -76.65 -43.79 36.67 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.031 177.25 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.626 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -57.13 -42.15 80.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -63.93 -33.94 76.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.975 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' 1038 ' ' VAL . 2.7 t-20 -67.38 -43.69 80.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 991' ' ' LEU . 16.3 tp -75.7 -24.39 56.24 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1036 ' ' LEU . . . . . 1.003 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -63.2 -32.67 74.12 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 120.876 0.369 . . . . 0.0 110.427 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.576 ' N ' HD23 ' A' 1036 ' ' LEU . 32.2 t70 -86.7 -36.9 18.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.853 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 25.4 t -52.82 -63.15 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.354 176.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.891 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.4 pt -81.54 -28.63 10.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.188 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -51.7 -48.41 63.55 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 163.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' 1045 ' ' LYS . 41.8 mt-30 -71.75 -25.94 62.25 Favored 'General case' 0 C--O 1.203 -1.35 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.224 177.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.628 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.7 -54.68 30.18 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 118.177 0.444 . . . . 0.0 110.969 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.62 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 2.0 mpt_? -55.35 -32.96 62.98 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.138 174.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.506 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 55.2 tp -72.61 -37.05 68.21 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.874 174.027 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 68.5 mmtt -58.88 -33.44 70.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.453 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 27.1 ttt -73.07 -37.16 66.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.576 -178.063 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' 1043 ' ' ARG . 51.4 mm -61.16 -45.77 97.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.2 t -56.47 -60.25 3.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.243 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 55.3 tp60 . . . . . 0 C--N 1.327 -0.41 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -174.796 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.635 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 36.0 m -86.91 26.45 1.14 Allowed 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.997 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.635 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.6 62.17 2.3 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.11 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.649 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 6.5 t0 -46.01 -176.17 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 125.733 1.895 . . . . 0.0 112.702 -173.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.8 tmtp? -36.59 -24.82 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 124.236 1.014 . . . . 0.0 111.914 177.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.883 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.1 m -58.63 -52.3 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.104 175.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 64.1 t80 -75.92 -24.66 55.56 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -176.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 31.1 mt-10 -70.51 -55.9 7.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.544 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.537 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 0.2 OUTLIER -73.77 -32.89 64.01 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.468 -176.586 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.961 HG11 ' HA ' ' A' 1036 ' ' LEU . 5.5 p -62.84 -35.83 72.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.294 176.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.669 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 6.5 p -72.43 -32.71 66.54 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.79 -31.28 67.47 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.35 172.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.649 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 2.8 tp -62.0 -46.79 87.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.551 ' O ' HG22 ' A' ' 936' ' ' VAL . 61.3 t -62.8 -37.78 80.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.907 0.384 . . . . 0.0 110.442 174.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.4 mmpt? -62.47 -31.97 72.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.388 0.613 . . . . 0.0 109.784 176.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.688 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -81.61 -24.6 36.31 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.561 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.744 ' O ' ' HG2' ' A' ' 939' ' ' MET . 1.6 m -79.61 -10.76 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 C-N-CA 119.211 -0.996 . . . . 0.0 109.358 172.097 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.531 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 67.0 mt -73.86 -30.54 28.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 167.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.6 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 7.5 mm-40 -55.21 -47.42 75.32 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.001 170.227 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.744 ' HG2' ' O ' ' A' ' 936' ' ' VAL . 11.5 ptt? -62.19 -40.6 96.6 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.283 0.364 . . . . 0.0 110.604 -175.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.5 p -68.9 -31.55 70.54 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.568 0.223 . . . . 0.0 111.27 -178.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.713 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.8 m -80.08 -42.75 23.05 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.5 tppp? -59.67 -39.34 84.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 113.268 -1.787 . . . . 0.0 111.479 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.785 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -73.64 -31.98 33.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 121.321 -0.152 . . . . 0.0 110.975 -179.455 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.1 mt-30 -49.91 -61.84 3.2 Favored Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.713 ' HD3' ' O ' ' A' ' 941' ' ' SER . 93.7 Cg_endo -99.12 16.1 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.09 1.86 . . . . 0.0 113.42 -172.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -116.39 151.84 47.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 5.4 Cg_exo -80.91 -179.63 5.26 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.766 2.978 . . . . 0.0 110.516 170.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 10.2 Cg_endo -53.41 -24.88 29.45 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.804 2.336 . . . . 0.0 113.063 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.461 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 36.3 mt-10 -57.17 -44.11 83.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.718 178.113 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.952 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.9 mp0 -94.03 1.09 56.27 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.569 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.628 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.6 m-85 -58.12 -45.56 87.07 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 170.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.089 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -72.33 -47.01 10.54 Favored Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 119.502 -0.879 . . . . 0.0 112.293 176.127 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.089 ' HD3' HG13 ' A' ' 952' ' ' VAL . 80.4 Cg_exo -51.47 -30.78 36.41 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 122.093 1.862 . . . . 0.0 115.108 171.262 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.785 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 2.4 ptt? -64.62 -46.02 84.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.95 -1.1 . . . . 0.0 108.653 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.673 ' N ' ' HG3' ' A' ' 954' ' ' MET . 0.3 OUTLIER -64.33 -25.06 37.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.777 173.827 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.4 ttmm -61.85 -37.59 85.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 176.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -59.35 -46.73 87.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.863 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 936' ' ' VAL . 9.0 m -65.5 -28.16 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.605 176.251 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.82 64.47 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.179 -1.01 . . . . 0.0 111.921 178.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.38 -36.63 71.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.95 0.405 . . . . 0.0 110.24 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.688 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -56.9 -56.04 26.73 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.792 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.532 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 30.6 tp -63.08 -35.5 80.47 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.649 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 52.1 mtm-85 -62.73 -48.95 77.02 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.272 176.379 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.508 HG22 ' OD1' ' A' ' 928' ' ' ASN . 5.5 m -56.08 -39.05 71.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.773 0.797 . . . . 0.0 109.792 172.185 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.592 HD22 HD22 ' A' ' 932' ' ' LEU . 64.8 tp -62.48 -27.66 69.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.974 176.035 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 86.1 mt -64.77 -28.94 69.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.331 178.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.84 -40.93 97.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.249 0.547 . . . . 0.0 109.713 172.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.755 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.5 m -61.46 -43.74 98.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.57 172.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.554 HG13 HD11 ' A' ' 984' ' ' ILE . 91.2 t -54.88 -31.42 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.157 177.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.9 t70 -75.78 -26.3 57.21 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.571 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 57.1 mm-40 -70.66 -49.15 50.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 122.709 1.242 . . . . 0.0 108.92 171.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.626 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.3 t -68.28 -24.69 64.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.67 -1.604 . . . . 0.0 111.649 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 3.8 tt -61.43 -51.45 77.38 Favored Pre-proline 0 C--O 1.218 -0.591 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.614 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.4 Cg_exo -59.82 -27.35 84.73 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 121.09 1.425 . . . . 0.0 111.214 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.7 t -78.24 -11.8 13.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.318 175.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.864 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.8 tt -65.64 -54.86 26.98 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.207 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.572 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 28.3 Cg_endo -64.84 -23.53 62.28 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.302 1.334 . . . . 0.0 111.186 174.417 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.94 -60.38 3.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.375 172.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.3 m -165.35 -34.43 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -177.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.827 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.0 m -55.83 -19.91 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -172.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.864 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 11.7 p-80 -49.74 -21.15 0.99 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.891 0.701 . . . . 0.0 112.891 -173.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -73.98 -52.96 11.14 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.672 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.035 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.75 -43.38 30.99 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.202 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.827 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -58.27 -34.75 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -173.316 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -73.81 -32.4 63.72 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.657 175.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.511 ' HE1' ' HG3' ' A' ' 983' ' ' GLU . 12.0 ptt? -69.14 -54.44 14.89 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.564 -175.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.679 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.08 -33.92 38.45 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 991' ' ' LEU . 53.3 tp60 -59.37 -46.42 88.69 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.258 0.481 . . . . 0.0 111.049 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -67.76 -25.69 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.505 0.669 . . . . 0.0 109.965 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 1.7 tp -73.25 -42.33 62.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.305 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.992 HD12 ' HA ' ' A' ' 988' ' ' GLN . 10.3 mt -58.57 -49.15 78.48 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 121.365 0.602 . . . . 0.0 109.897 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.452 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 10.2 t30 -55.73 -41.08 73.35 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.545 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.6 t -69.48 -43.09 73.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.61 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 35.7 m-20 -95.63 -41.0 9.12 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.195 -0.602 . . . . 0.0 112.383 -169.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.042 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.38 -53.13 61.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 175.317 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 992' ' ' ASN . . . -60.6 -48.58 81.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.439 -177.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.0 pt-20 -64.34 -32.02 73.45 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 118.949 -1.1 . . . . 0.0 111.414 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.725 HD23 HD13 ' A' 1028 ' ' LEU . 54.9 tp -64.48 -38.27 90.43 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.852 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.549 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 76.8 mt -55.59 -39.22 53.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.401 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.694 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 33.8 m-80 -95.49 -5.27 43.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.004 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 15.8 tptp -83.35 -44.39 14.91 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.477 ' SD ' ' HB3' ' A' ' 951' ' ' TYR . 40.0 tpp -78.51 -31.14 47.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.947 173.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.761 ' O ' ' HB2' ' A' 1007 ' ' GLN . 83.3 tttt -58.34 -49.21 77.99 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 171.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1004 ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.33 -37.29 82.73 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.43 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -67.63 -44.8 77.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.381 0.61 . . . . 0.0 110.69 178.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.7 pp0? -74.26 -9.72 58.89 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.761 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp60 -91.53 -10.5 40.48 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.124 -0.943 . . . . 0.0 109.718 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 26.1 t80 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.271 -177.308 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.446 ' OE1' ' HB2' ' A' 1018 ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.053 0.454 . . . . 0.0 109.884 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.562 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 46.5 mt-30 -67.42 -30.68 70.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.779 -175.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.58 -47.44 57.95 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.675 169.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.6 m-30 -77.42 -24.71 50.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.776 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.562 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 83.9 tttt -72.44 -37.21 68.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.754 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -66.77 -50.81 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -46.86 -40.99 14.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.271 170.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.466 ' HB3' ' O ' ' A' 1018 ' ' LYS . 14.3 tmm? -61.46 -43.15 99.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.443 177.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.6 -42.0 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.755 0.312 . . . . 0.0 111.089 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 12.5 m -63.36 -36.4 83.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.064 0.459 . . . . 0.0 110.551 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.25 -36.23 47.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.814 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.638 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.1 -31.87 73.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.628 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 61.4 t60 -72.1 -46.38 56.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.109 176.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.79 85.97 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.088 0.471 . . . . 0.0 109.981 177.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.042 HD12 ' HA ' ' A' ' 995' ' ' LEU . 2.0 tt -58.74 -51.77 68.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.557 172.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.82 65.38 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.712 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 84.5 t -66.4 -33.81 65.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 174.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.671 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.1 p30 -71.89 -41.92 67.39 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -55.81 -50.37 70.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 0.0 110.025 171.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.556 ' O ' ' HB3' ' A' 1036 ' ' LEU . 13.3 tptm -66.5 -37.17 84.49 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.921 -1.036 . . . . 0.0 112.005 -174.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.571 ' O ' HG23 ' A' 1038 ' ' VAL . 60.4 t30 -75.71 -35.11 60.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.412 -174.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.761 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 7.0 tp -77.67 -30.04 51.8 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.961 ' HA ' HG11 ' A' ' 929' ' ' VAL . 6.4 tt -48.77 -41.67 33.16 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.698 0.761 . . . . 0.0 109.538 172.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -75.71 -46.74 29.47 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.205 174.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.035 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.7 t -48.02 -58.91 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.883 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.6 pp -83.44 -30.46 8.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.737 ' H ' HD12 ' A' 1039 ' ' ILE . 5.5 t0 -56.94 -42.48 80.14 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 165.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' A' 1045 ' ' LYS . 55.0 mt-30 -75.12 -23.62 57.93 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-N 114.332 -1.304 . . . . 0.0 110.837 174.082 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.64 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.38 -55.36 29.4 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 118.818 0.735 . . . . 0.0 110.721 171.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.649 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 0.9 OUTLIER -58.66 -27.67 64.98 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.703 173.803 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.557 HD23 ' O ' ' A' 1044 ' ' LEU . 5.8 tt -75.35 -32.87 61.0 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.018 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.836 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 74.1 mmtt -61.39 -30.28 70.45 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 175.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 24.5 ttt -77.23 -30.26 54.48 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.931 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.467 ' HB ' ' O ' ' A' 1044 ' ' LEU . 48.5 mm -65.36 -46.55 90.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 169.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 52.4 m -55.67 -37.54 68.43 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.972 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 48.4 tt0 . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.341 175.932 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 1.055 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 21.1 t -97.78 25.55 5.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.175 0.512 . . . . 0.0 109.728 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.11 62.33 2.72 Favored 'General case' 0 CA--C 1.498 -1.045 0 CA-C-O 122.129 0.966 . . . . 0.0 109.479 -176.399 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.512 ' O ' ' N ' ' A' ' 925' ' ' VAL . 29.4 m-20 -44.62 -171.6 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 110.77 -2.923 . . . . 0.0 113.547 -176.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.502 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 1.2 tmtm? -38.09 -17.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.883 0.873 . . . . 0.0 112.865 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 1.03 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 15.8 m -65.05 -52.97 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 O-C-N 122.155 -0.341 . . . . 0.0 111.719 177.163 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.526 ' N ' HG23 ' A' ' 925' ' ' VAL . 46.4 t80 -75.89 -22.3 56.27 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -174.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -74.52 -61.64 1.8 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.209 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.438 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -65.96 -31.79 72.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.806 -173.972 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.802 HG11 ' HA ' ' A' 1036 ' ' LEU . 11.0 p -65.25 -43.42 95.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.606 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 18.4 p -71.21 -25.17 62.4 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.549 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.77 -27.95 62.39 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.028 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.908 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.8 tt -65.56 -46.43 79.52 Favored 'General case' 0 CA--C 1.523 -0.065 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 172.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.1 t -58.71 -41.71 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.644 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.7 OUTLIER -65.49 -27.69 68.67 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.061 0.457 . . . . 0.0 110.972 177.596 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.599 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -81.28 -26.17 35.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.198 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.59 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -82.96 -12.49 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.638 0.733 . . . . 0.0 109.489 172.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 933' ' ' VAL . 49.4 mm -66.95 -34.6 71.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.8 mt-10 -62.18 -47.53 84.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.063 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.8 ttp -55.57 -39.74 71.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.19 176.15 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.627 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 13.3 t -61.93 -38.2 87.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.07 0.462 . . . . 0.0 110.546 178.114 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.566 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.0 m -78.24 -40.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.165 0.983 . . . . 0.0 108.597 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.697 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 5.9 tmtp? -67.86 -34.94 77.66 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.278 -177.051 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.561 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 0.0 OUTLIER -73.4 -28.4 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.281 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.68 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 74.5 mt-30 -49.7 -54.24 33.59 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.624 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.6 Cg_endo -99.63 21.43 0.26 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.94 1.76 . . . . 0.0 113.37 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -94.95 130.11 33.79 Favored Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -171.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 92.9 Cg_endo -85.31 -179.31 3.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.034 2.489 . . . . 0.0 108.94 158.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.745 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 73.5 Cg_exo -51.07 -33.7 44.21 Favored 'Trans proline' 0 C--O 1.241 0.647 0 C-N-CA 122.048 1.832 . . . . 0.0 112.089 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.549 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 5.0 mp0 -55.07 -42.24 72.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.244 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.64 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 29.7 mm-40 -94.86 -5.8 44.19 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.468 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.745 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 12.1 m-30 -59.82 -37.32 78.84 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.941 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -73.3 -53.47 4.71 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 120.282 -0.567 . . . . 0.0 112.054 176.464 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.941 ' HD3' HG13 ' A' ' 952' ' ' VAL . 63.6 Cg_exo -56.65 -31.57 87.78 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.033 1.822 . . . . 0.0 114.454 175.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 939' ' ' MET . 18.4 ptt? -68.42 -36.71 79.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.232 1.015 . . . . 0.0 109.592 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.969 HG11 ' HA ' ' A' ' 999' ' ' ILE . 84.3 t -71.87 -25.41 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.868 174.161 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.567 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 59.4 tttp -56.24 -39.51 72.67 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.75 -48.17 75.73 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.032 175.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.59 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.8 m -76.52 -22.82 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-O 120.944 0.402 . . . . 0.0 112.017 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.55 -42.17 64.11 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.675 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.25 -24.57 63.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.91 0.386 . . . . 0.0 110.004 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.0 -56.39 22.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.62 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.581 HD11 HD13 ' A' ' 991' ' ' LEU . 53.7 tp -72.4 -31.5 65.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.199 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.461 ' HD3' ' C ' ' A' ' 963' ' ' ARG . 3.3 tmt_? -61.54 -53.67 53.34 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.438 HG22 ' OD1' ' A' ' 928' ' ' ASN . 15.7 m -59.14 -32.34 69.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.301 0.572 . . . . 0.0 110.526 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 932' ' ' LEU . 0.5 OUTLIER -63.79 -41.67 97.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.937 177.254 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 96.6 mt -53.04 -31.22 40.22 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.317 174.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -49.61 74.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.415 0.626 . . . . 0.0 109.795 173.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.844 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -56.2 -46.23 79.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.629 170.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.474 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -53.36 -30.81 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.81 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 13.0 t70 -70.6 -33.1 70.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.325 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.8 mm-40 -60.49 -54.59 43.73 Favored 'General case' 0 C--O 1.247 0.946 0 CA-C-O 122.603 1.192 . . . . 0.0 108.46 171.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 40.0 t -55.61 -26.82 46.12 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 114.224 -1.353 . . . . 0.0 112.129 174.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 1.034 ' HA ' HD13 ' A' ' 976' ' ' LEU . 7.0 tt -57.99 -53.85 61.57 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-O 118.7 -0.666 . . . . 0.0 111.743 -174.343 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.644 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.8 Cg_exo -54.87 -26.99 51.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 CA-C-N 120.857 1.342 . . . . 0.0 111.25 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.737 HG13 ' HB2' ' A' 1046 ' ' MET . 3.8 t -78.3 -17.32 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 120.073 -0.651 . . . . 0.0 111.554 176.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 1.038 ' HG ' HG21 ' A' ' 984' ' ' ILE . 8.6 mp -56.86 -64.37 2.59 Favored Pre-proline 0 N--CA 1.471 0.616 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.36 173.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.724 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 15.2 Cg_endo -57.67 -30.33 88.5 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.625 1.55 . . . . 0.0 111.826 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -58.17 -57.39 13.08 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.355 174.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 979' ' ' SER . . . . . 1.063 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 59.9 m -163.3 -47.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.118 0.485 . . . . 0.0 111.463 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.726 HG22 ' HB ' ' A' ' 984' ' ' ILE . 23.8 m -48.54 -24.12 1.21 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 984' ' ' ILE . 49.8 p-80 -50.06 -32.51 15.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -66.71 -52.86 39.65 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 119.455 1.025 . . . . 0.0 111.968 176.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.744 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.2 OUTLIER -70.71 -45.54 64.76 Favored 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.338 -179.23 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 1.038 HG21 ' HG ' ' A' ' 976' ' ' LEU . 8.8 tp -57.68 -39.38 69.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.609 -175.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 11.7 pt-20 -69.98 -27.28 64.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.014 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.587 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 5.4 ptp -71.97 -46.74 56.26 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.801 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.908 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -72.48 -47.09 51.52 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.847 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.871 ' HA ' HD12 ' A' ' 991' ' ' LEU . 27.2 tt0 -57.59 -45.69 84.95 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -175.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -65.22 -35.08 79.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.441 0.639 . . . . 0.0 109.315 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.77 -35.6 78.99 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.682 177.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 988' ' ' GLN . 15.6 mt -61.3 -57.47 12.2 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.316 0.579 . . . . 0.0 109.671 175.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -45.8 -43.0 12.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.053 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 17.1 p -76.26 -46.55 27.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -178.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.538 ' HB2' ' HB3' ' A' 1031 ' ' ASP . 1.0 OUTLIER -82.65 -37.32 25.05 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -169.516 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.704 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -58.61 -47.0 85.83 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 168.443 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.826 ' HA ' HG22 ' A' ' 999' ' ' ILE . . . -52.7 -28.38 21.66 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 993' ' ' SER . 77.1 mt-10 -77.13 -34.08 56.67 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 118.575 -1.25 . . . . 0.0 108.693 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.666 HD23 HD13 ' A' 1028 ' ' LEU . 18.6 tp -78.23 -29.03 48.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.969 ' HA ' HG11 ' A' ' 955' ' ' VAL . 5.8 tt -77.21 -0.74 3.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-O 121.908 0.861 . . . . 0.0 108.827 172.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.695 ' HA ' ' HB2' ' A' 1003 ' ' LYS . 6.8 m-80 -102.78 -6.36 22.67 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.62 170.343 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1001 ' ' LYS . . . . . 1.01 ' HD3' ' HB2' ' A' 1021 ' ' MET . 42.3 tptt -73.12 -36.8 66.78 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 162.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.745 ' HB2' ' HB ' ' A' ' 955' ' ' VAL . 24.2 ttm -64.77 -60.96 2.49 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.42 -1.264 . . . . 0.0 108.626 171.412 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.779 ' O ' ' HB2' ' A' 1007 ' ' GLN . 45.3 mttp -65.17 -57.11 9.38 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.241 -174.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.665 HD23 ' HB3' ' A' 1017 ' ' TYR . 8.4 tt -82.3 -31.31 30.06 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -163.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.532 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -71.33 -43.19 67.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.075 178.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -76.79 -26.28 54.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.458 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.779 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.9 tp-100 -53.83 -52.96 58.68 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.828 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.629 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 28.1 m-85 . . . . . 0 C--N 1.321 -0.639 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.851 -175.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.736 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.415 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 2.6 mp0 -59.88 -22.41 62.31 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.213 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -53.99 -59.54 4.5 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 167.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.736 ' CD2' ' HA ' ' A' 1014 ' ' GLN . 0.3 OUTLIER -61.55 -20.43 63.25 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.725 ' O ' ' HB3' ' A' 1021 ' ' MET . 39.5 ttmt -79.35 -43.46 23.48 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.301 171.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -68.04 -41.88 81.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.397 0.618 . . . . 0.0 109.343 177.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -56.23 -31.46 63.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.696 173.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1021 ' ' MET . . . . . 1.01 ' HB2' ' HD3' ' A' 1001 ' ' LYS . 43.5 ttp -56.49 -44.73 80.93 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 173.369 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.69 -43.05 76.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.595 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.1 m -71.38 -46.57 59.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.714 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.94 76.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.713 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -64.26 -36.35 83.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 110.491 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.594 ' O ' HG23 ' A' 1030 ' ' VAL . 14.1 t-80 -66.94 -42.25 85.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.16 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.53 -47.54 85.09 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.477 0.485 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.9 OUTLIER -65.41 -42.26 92.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.588 0.709 . . . . 0.0 110.233 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.61 -28.95 61.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.907 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' 1026 ' ' HIS . 74.2 t -74.29 -47.69 39.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.122 177.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.704 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -59.74 -42.36 92.99 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.694 179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -62.83 -49.95 72.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.982 0.42 . . . . 0.0 110.436 175.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.731 ' HA ' HD23 ' A' 1036 ' ' LEU . 87.6 tttt -59.81 -38.51 82.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.706 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.533 ' O ' HG23 ' A' 1038 ' ' VAL . 17.1 t-20 -72.4 -53.72 11.43 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.315 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 991' ' ' LEU . 29.0 tp -56.5 -33.96 66.5 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.141 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.802 ' HA ' HG11 ' A' ' 929' ' ' VAL . 1.8 pp -61.79 -38.67 88.92 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.809 0.731 . . . . 0.0 109.396 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.0 t70 -66.97 -40.07 87.36 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.181 174.225 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.908 HG21 ' HB2' ' A' ' 987' ' ' ALA . 76.7 t -60.87 -68.44 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.653 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1039 ' ' ILE . . . . . 1.03 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -70.07 -33.75 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -173.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.74 ' H ' HD12 ' A' 1039 ' ' ILE . 6.9 t70 -48.81 -45.18 40.04 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 122.43 1.109 . . . . 0.0 108.372 166.547 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' A' 1045 ' ' LYS . 82.1 mm-40 -79.11 -24.84 43.13 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 113.487 -1.688 . . . . 0.0 111.134 177.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.01 -55.02 31.15 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.526 173.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1043 ' ' ARG . . . . . 1.055 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 21.8 mmm180 -57.86 -32.97 68.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.829 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.634 HD12 ' HB ' ' A' 1047 ' ' ILE . 60.3 tp -77.99 -26.33 48.55 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 121.113 -0.235 . . . . 0.0 111.235 175.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1045 ' ' LYS . . . . . 1.063 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 46.7 mmtm -57.08 -44.45 83.11 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.664 0.745 . . . . 0.0 109.536 171.087 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.737 ' HB2' HG13 ' A' ' 975' ' ' VAL . 26.9 ttt -65.62 -38.93 90.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.66 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.634 ' HB ' HD12 ' A' 1044 ' ' LEU . 49.7 mm -66.87 -35.81 75.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.894 175.254 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 36.9 t -60.55 -53.85 52.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.91 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 C--N 1.328 -0.356 0 CA-C-O 121.046 0.451 . . . . 0.0 110.911 -178.363 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.938 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 20.3 tpt180 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 67.5 m 71.27 105.37 0.06 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -160.32 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.687 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -53.53 85.44 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -166.884 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 922' ' ' ASN . 1.9 t70 -47.16 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 112.785 -2.007 . . . . 0.0 113.238 -174.307 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.9 tmtp? -41.82 -23.15 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.428 -178.534 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.823 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 1.9 m -56.41 -54.86 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 118.745 -0.645 . . . . 0.0 112.048 172.716 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.687 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 20.2 t80 -74.37 -34.91 63.5 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 118.843 -1.143 . . . . 0.0 107.934 -175.133 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 11.8 mm-40 -58.68 -57.27 13.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.113 -1.858 . . . . 0.0 112.877 -176.47 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.463 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 3.1 t-20 -73.72 -35.26 65.08 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.905 -171.554 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.774 HG22 ' CD2' ' A' ' 965' ' ' LEU . 3.8 t -61.69 -36.03 71.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.036 -0.666 . . . . 0.0 110.235 175.012 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.568 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 42.5 m -66.5 -37.75 85.74 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 171.942 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.36 -30.37 64.58 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.691 174.3 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.564 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.42 -39.38 90.56 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 173.946 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG13 ' A' ' 937' ' ' ILE . 48.0 t -66.14 -40.73 87.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.607 173.256 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.5 OUTLIER -61.73 -33.69 74.49 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 178.438 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -80.63 -26.56 37.65 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.33 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.567 ' O ' ' HG2' ' A' ' 939' ' ' MET . 9.5 p -78.19 -16.44 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 119.448 -0.901 . . . . 0.0 108.877 171.639 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.617 HG13 ' O ' ' A' ' 933' ' ' VAL . 51.4 mt -67.33 -38.13 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 167.112 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.676 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 64.9 mm-40 -52.52 -38.52 59.84 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.123 172.221 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.929 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.9 ptt? -61.63 -40.57 95.34 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 t -74.24 -31.05 62.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.378 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.676 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.1 t -71.57 -52.55 17.57 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.538 0.685 . . . . 0.0 110.095 -176.273 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.53 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -80.18 -11.03 59.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.03 -173.602 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.976 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -79.65 -26.97 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.748 0.785 . . . . 0.0 109.264 173.772 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.8 mt-30 -60.97 -51.77 76.98 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.83 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.676 ' HD3' ' O ' ' A' ' 941' ' ' SER . 85.5 Cg_endo -97.3 17.57 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.459 1.439 . . . . 0.0 114.992 -176.54 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -130.65 167.47 21.07 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.724 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.411 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 6.5 Cg_endo -90.52 170.02 3.81 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 124.031 3.154 . . . . 0.0 111.776 168.954 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.555 ' C ' ' H ' ' A' ' 950' ' ' GLU . 5.4 Cg_endo -47.06 -26.68 5.31 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 124.908 3.739 . . . . 0.0 115.023 -167.028 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 8.7 mm-40 -52.5 0.7 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.921 170.349 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.976 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -106.9 -25.17 11.77 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 109.74 -0.466 . . . . 0.0 109.74 179.31 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.493 ' O ' ' HG2' ' A' ' 954' ' ' MET . 21.6 m-85 -47.02 -42.34 18.07 Favored 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 173.27 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.024 HG13 ' HD3' ' A' ' 953' ' ' PRO 0.25 0.4 OUTLIER -73.89 -58.29 2.17 Favored Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 119.028 -1.069 . . . . 0.0 113.024 178.52 . . . . . . . . 4 4 . 1 . 021 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.024 ' HD3' HG13 ' A' ' 952' ' ' VAL . 36.0 Cg_exo -64.4 -18.52 63.37 Favored 'Trans proline' 0 C--N 1.358 1.075 0 C-N-CA 121.92 1.747 . . . . 0.0 114.631 178.011 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.929 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 22.7 ptt? -70.8 -43.09 69.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 176.797 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.777 ' HB ' ' HB3' ' A' 1002 ' ' MET . 78.9 t -68.54 -27.64 37.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.664 172.329 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.4 tptm -52.32 -45.08 65.45 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 171.818 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' A' ' 954' ' ' MET . 4.7 mm-40 -56.34 -46.77 79.78 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.988 177.648 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.567 HG12 ' HA ' ' A' ' 955' ' ' VAL . 9.8 p -81.93 -22.18 9.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -178.546 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.651 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -70.46 -45.34 54.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.842 -1.17 . . . . 0.0 112.016 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.433 HD23 ' HD3' ' A' ' 963' ' ' ARG . 87.5 mt -65.92 -24.35 66.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.686 0.279 . . . . 0.0 110.443 170.642 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.8 -55.41 30.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.665 175.865 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.917 HD13 ' HB2' ' A' ' 995' ' ' LEU . 6.7 tt -66.4 -27.45 67.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.501 -0.479 . . . . 0.0 110.656 179.609 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.433 ' HD3' HD23 ' A' ' 960' ' ' LEU . 17.1 mtp180 -65.69 -48.07 73.27 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.961 -0.462 . . . . 0.0 111.287 171.037 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 22.1 m -55.99 -40.52 73.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.739 0.781 . . . . 0.0 109.68 171.296 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.774 ' CD2' HG22 ' A' ' 929' ' ' VAL . 1.3 tm? -59.32 -28.69 67.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.482 175.151 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 963' ' ' ARG . 0.4 OUTLIER -68.28 -25.08 64.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.993 178.982 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 971' ' ' GLU . . . -68.74 -36.96 79.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.101 171.98 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.779 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.1 m -64.44 -40.8 96.43 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.379 172.972 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.577 HG13 HD11 ' A' ' 984' ' ' ILE . 85.4 t -55.35 -32.36 29.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.2 172.091 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.523 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.6 t70 -80.06 -29.53 39.22 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.806 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.6 mm-40 -64.13 -50.22 69.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.617 1.198 . . . . 0.0 108.828 170.527 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.592 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.0 t -64.55 -23.11 67.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.306 176.312 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.657 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 60.1 tp -57.02 -52.93 70.4 Favored Pre-proline 0 C--O 1.218 -0.558 0 CA-C-O 118.713 -0.661 . . . . 0.0 112.431 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.645 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.4 Cg_exo -58.14 -27.99 82.17 Favored 'Trans proline' 0 C--N 1.357 1.024 0 CA-C-N 121.202 1.465 . . . . 0.0 111.044 169.364 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 1046 ' ' MET . 3.1 t -78.4 -8.56 11.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.508 176.605 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.998 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.6 tt -70.92 -52.79 9.4 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 118.942 -0.552 . . . . 0.0 111.077 177.347 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.576 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 32.6 Cg_endo -66.64 -18.57 53.87 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.291 1.327 . . . . 0.0 111.123 173.069 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.89 -55.72 8.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.567 171.39 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.6 m -171.34 -36.73 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.101 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.639 HG22 ' HB ' ' A' ' 984' ' ' ILE . 6.9 m -58.04 -17.18 16.03 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -171.008 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.998 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 5.3 p-80 -48.46 -19.59 0.34 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.811 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 -75.53 -55.19 5.91 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.874 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.001 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -79.41 -40.17 30.68 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.29 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.639 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.7 tp -54.62 -35.89 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.719 -172.764 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 9.0 pt-20 -76.33 -38.19 56.3 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.884 176.728 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.719 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 3.6 ptp -59.37 -50.74 72.79 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.832 -173.917 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.68 ' N ' ' HG3' ' A' ' 986' ' ' MET . . . -78.58 -37.4 42.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.461 -176.434 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.975 ' HA ' HD12 ' A' ' 991' ' ' LEU . 1.4 tm0? -61.86 -40.59 95.88 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.297 -177.255 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 38.6 mmtm -59.54 -40.69 88.03 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 173.663 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -68.27 -36.07 78.85 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.896 -179.168 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.975 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -59.97 -49.38 77.91 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.183 0.516 . . . . 0.0 110.33 178.583 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -54.4 -42.82 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.797 -178.184 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 63.0 m -74.69 -38.87 62.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.175 -176.786 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.536 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.0 OUTLIER -89.33 -39.59 13.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -169.784 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.917 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.5 tm? -61.08 -31.43 71.1 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 168.744 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.68 -50.0 75.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.594 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.63 -32.36 71.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.807 174.828 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 1.016 HD21 ' HA ' ' A' 1025 ' ' ALA . 0.2 OUTLIER -65.77 -34.52 78.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.888 0.375 . . . . 0.0 110.463 175.668 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -61.99 -35.7 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.585 0.707 . . . . 0.0 109.385 174.557 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.724 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.3 m-80 -85.46 -13.16 50.06 Favored 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.507 176.631 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.875 ' HG2' ' HB2' ' A' 1021 ' ' MET . 0.1 OUTLIER -68.76 -40.18 79.87 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.049 0.452 . . . . 0.0 110.251 175.963 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.992 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.8 ptt? -78.64 -34.17 46.66 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.817 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.724 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 81.4 tttt -73.48 -55.71 5.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.95 -177.416 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.1 mp -54.42 -45.16 72.92 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.7 84.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.176 0.512 . . . . 0.0 110.067 177.95 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.885 ' HG3' HG12 ' A' ' 952' ' ' VAL . 15.5 mm100 -78.69 -9.8 59.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.799 0.809 . . . . 0.0 112.09 178.52 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.591 ' HB2' ' O ' ' A' 1003 ' ' LYS . 18.1 tp60 -77.91 -43.76 29.04 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.439 175.798 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.419 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 2.9 t80 . . . . . 0 C--N 1.324 -0.535 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.311 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 121.275 0.56 . . . . 0.0 110.68 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.9 pt20 -55.15 -33.89 63.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.196 -169.375 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -50.77 -51.12 53.43 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 111.279 173.342 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.419 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.1 m-30 -76.87 -21.61 54.7 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.512 178.309 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.495 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 38.6 ttpt -65.27 -39.82 93.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.425 177.65 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.94 -57.06 13.17 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.319 0.58 . . . . 0.0 109.885 176.185 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -48.85 -49.7 38.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.461 176.161 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.875 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 0.0 OUTLIER -73.81 -19.0 60.88 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.435 -176.759 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.55 -48.09 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.784 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.2 m -63.93 -33.76 76.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.361 177.301 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -62.93 -33.6 75.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 178.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1025 ' ' ALA . . . . . 1.016 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -69.69 -31.28 69.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 178.923 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.536 ' O ' HG23 ' A' 1030 ' ' VAL . 22.5 t-80 -64.88 -34.59 78.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.379 176.76 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.536 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -57.57 -46.94 83.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.054 175.823 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.858 HD13 ' HG ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -62.49 -46.27 89.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.88 0.847 . . . . 0.0 110.554 177.39 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.81 -36.98 68.05 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.732 -179.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' 1026 ' ' HIS . 88.6 t -65.9 -35.7 75.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 173.283 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.666 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.72 -39.21 73.52 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.108 -178.478 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.71 -53.43 56.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.073 171.89 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.597 ' O ' ' HG ' ' A' 1036 ' ' LEU . 2.9 tmtp? -60.32 -48.21 82.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.048 -174.195 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' 1038 ' ' VAL . 13.4 t-20 -64.86 -36.53 84.64 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.823 -176.016 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.884 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.98 -33.18 45.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 119.694 -0.193 . . . . 0.0 110.516 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.887 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.2 pp -67.64 -18.35 64.93 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 120.961 0.41 . . . . 0.0 109.899 -178.967 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -88.73 -38.91 14.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.222 169.771 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.001 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -50.68 -61.56 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.938 173.136 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.887 HD11 ' HA ' ' A' 1036 ' ' LEU . 1.7 pp -78.58 -24.22 13.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.125 -178.136 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.686 ' N ' HD12 ' A' 1039 ' ' ILE . 13.8 t0 -59.56 -36.18 75.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 164.809 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.8 mm-40 -72.57 -36.58 68.23 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.678 170.695 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.641 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -51.66 -53.22 41.2 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 123.223 0.327 . . . . 0.0 111.241 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.938 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 7.7 ppt_? -52.42 -38.99 60.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.699 176.009 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.638 ' N ' ' HD2' ' A' 1043 ' ' ARG . 48.2 tp -80.47 -23.42 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 121.001 -0.279 . . . . 0.0 111.29 177.487 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.774 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 28.5 mmmt -62.95 -42.68 99.89 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.668 0.747 . . . . 0.0 109.062 176.077 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.477 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.6 tmt? -61.84 -39.19 90.98 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.191 175.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 37.4 mm -61.05 -36.6 73.59 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.255 173.618 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.0 t -62.4 -21.9 65.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.869 0.366 . . . . 0.0 111.04 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.071 178.615 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.767 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 20.5 tpt180 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 18.3 m 70.88 5.57 5.51 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 123.073 0.549 . . . . 0.0 110.646 -177.456 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.5 OUTLIER 55.67 78.15 0.2 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.317 171.981 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.514 ' CG ' ' HG3' ' A' 1043 ' ' ARG . 2.4 p30 -55.03 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 112.356 -2.202 . . . . 0.0 112.257 -176.006 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.559 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 3.4 tmtp? -25.38 -25.24 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.238 1.415 . . . . 0.0 114.384 177.092 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.845 HG21 ' HG2' ' A' 1043 ' ' ARG . 13.4 m -62.79 -52.79 55.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 174.263 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.522 ' N ' HG23 ' A' ' 925' ' ' VAL . 60.9 t80 -77.59 -31.17 52.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.163 0.982 . . . . 0.0 108.586 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 930' ' ' THR . 39.8 mt-10 -68.0 -49.77 59.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.931 -179.407 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.559 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 41.3 t30 -73.96 -30.33 62.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.693 HG22 HD11 ' A' ' 965' ' ' LEU . 45.2 t -64.75 -42.39 94.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.811 173.25 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.714 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.7 m -50.57 -29.4 10.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.204 0.526 . . . . 0.0 110.007 165.397 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 931' ' ' GLY . . . . . 0.407 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -70.77 -27.97 71.52 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.822 178.125 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.766 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.2 tt -64.61 -45.58 86.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.033 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.683 ' O ' HG12 ' A' ' 937' ' ' ILE . 35.2 t -57.04 -45.69 84.05 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.726 173.214 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.714 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.9 mmpt? -56.21 -45.5 79.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.701 178.117 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -77.48 -26.08 51.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.866 -177.41 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.597 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.4 p -80.44 -15.76 12.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.466 172.895 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.683 HG12 ' O ' ' A' ' 933' ' ' VAL . 25.0 mm -69.19 -28.06 37.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.479 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.555 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 11.1 mm-40 -62.49 -47.05 85.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.256 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.493 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 24.1 ttt -57.05 -38.44 73.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.704 174.944 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.622 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 19.5 m -67.29 -40.73 86.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.127 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.5 t -76.43 -42.78 42.89 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -177.766 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 7.6 mmtm -48.45 -56.18 8.94 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 113.534 -1.666 . . . . 0.0 111.293 175.958 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.685 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.4 tt -66.61 -25.26 34.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 123.651 0.594 . . . . 0.0 112.006 -173.518 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.794 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 81.4 mm-40 -51.92 -59.54 8.01 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 119.44 -0.314 . . . . 0.0 111.777 -179.299 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.794 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.0 Cg_endo -100.64 14.9 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.631 1.554 . . . . 0.0 113.555 174.896 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.645 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -75.75 137.59 70.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -174.341 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 950' ' ' GLU . 93.3 Cg_endo -85.63 178.74 4.22 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 123.141 2.561 . . . . 0.0 109.47 160.05 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.642 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 8.5 Cg_endo -51.45 -36.66 59.64 Favored 'Trans proline' 0 C--O 1.247 0.97 0 C-N-CA 122.479 2.119 . . . . 0.0 111.943 176.572 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -59.44 -16.16 21.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.582 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.541 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . 0.8 OUTLIER -114.36 -9.49 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.558 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.725 ' O ' ' HG2' ' A' ' 954' ' ' MET . 24.4 m-85 -58.65 -41.83 86.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.584 0.706 . . . . 0.0 109.523 172.702 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -73.68 -52.04 5.01 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.374 177.236 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.2 Cg_exo -56.04 -27.46 64.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.963 1.775 . . . . 0.0 115.152 173.262 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.725 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 24.8 ptt? -68.5 -42.98 77.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.676 0.751 . . . . 0.0 109.601 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.769 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.3 t -71.32 -24.73 24.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.581 174.739 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.615 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 48.0 tttm -56.47 -43.56 79.69 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 173.469 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.449 ' HB3' ' HB2' ' A' ' 938' ' ' GLU . 4.5 mm-40 -54.05 -47.87 71.17 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.106 173.655 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.578 HG12 ' O ' ' A' ' 955' ' ' VAL . 4.5 p -69.94 -21.12 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.116 177.936 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.615 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -63.59 -41.43 99.13 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 170.575 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 41.6 tp -73.74 -10.18 59.42 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.248 0.547 . . . . 0.0 110.275 175.333 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.766 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -76.14 -56.4 4.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.468 -177.774 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.496 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 59.7 tp -76.02 -17.15 59.8 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.844 0.355 . . . . 0.0 110.43 175.399 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.787 ' HE ' ' HA ' ' A' ' 963' ' ' ARG . 0.3 OUTLIER -64.71 -65.76 0.63 Allowed 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.472 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 6.1 m -58.52 -22.09 54.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.353 175.479 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.693 HD11 HG22 ' A' ' 929' ' ' VAL . 19.8 tp -75.4 -36.81 60.8 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.771 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.5 -33.99 56.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.829 172.583 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -58.46 -49.84 75.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.179 173.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 925' ' ' VAL . 9.4 m -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.961 171.684 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.9 t -54.79 -32.02 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 122.384 -0.198 . . . . 0.0 110.715 174.869 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.476 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 10.6 t70 -69.17 -32.31 71.54 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.309 176.319 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 60.1 mm-40 -60.59 -57.86 10.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 122.294 1.045 . . . . 0.0 109.111 172.651 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.531 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.3 t -66.52 -22.69 66.17 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.341 -1.3 . . . . 0.0 112.264 -178.003 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.772 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.1 tp -61.67 -48.61 89.44 Favored Pre-proline 0 C--O 1.217 -0.644 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.082 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.727 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 31.5 Cg_exo -63.54 -26.87 69.71 Favored 'Trans proline' 0 C--N 1.356 0.933 0 CA-C-N 121.58 1.6 . . . . 0.0 110.683 167.904 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.715 HG12 ' HE2' ' A' 1045 ' ' LYS . 19.4 t -74.34 -12.63 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.545 176.556 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 0.7 OUTLIER -72.16 -54.0 6.06 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.128 177.778 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 24.4 Cg_exo -63.51 -22.61 70.93 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.392 1.395 . . . . 0.0 110.643 178.753 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -61.25 2.33 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.027 171.759 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.999 ' HB2' ' HD3' ' A' 1045 ' ' LYS . 29.0 m -161.07 -42.62 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.813 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.659 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.3 m -45.97 -21.1 0.11 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.14 1.534 . . . . 0.0 115.14 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.703 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 78.7 t60 -47.63 -36.48 10.96 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.726 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 4.9 ptp180 -61.52 -56.07 24.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.739 176.747 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.798 ' HG3' HG22 ' A' 1038 ' ' VAL . 0.6 OUTLIER -76.79 -49.33 16.13 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.141 -0.623 . . . . 0.0 112.025 -174.793 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.661 ' HA ' HG11 ' A' 1038 ' ' VAL . 11.2 tt -50.58 -42.29 21.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.376 -174.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -68.1 -30.17 69.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.982 -177.16 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.68 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.5 ptm -62.51 -57.1 12.39 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.121 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.92 -34.94 38.53 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -176.961 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -55.48 -52.68 62.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.951 0.405 . . . . 0.0 110.44 -177.407 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -73.16 -23.91 60.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.64 . . . . 0.0 109.854 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.645 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 18.6 tp -65.9 -51.66 56.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.718 175.861 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.77 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.4 mt -53.08 -52.1 59.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.644 175.264 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -48.09 -43.05 30.36 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.358 178.329 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 50.4 m -65.02 -50.54 65.86 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.901 -178.001 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.637 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.3 m-20 -94.86 -25.41 16.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -169.271 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.615 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.9 tm? -52.84 -55.5 22.61 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.859 0.754 . . . . 0.0 109.265 165.655 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -52.71 -41.16 63.68 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.639 173.987 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.83 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.5 mm-40 -58.04 -48.58 79.66 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 123.779 0.674 . . . . 0.0 109.782 178.532 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' 1025 ' ' ALA . 31.2 tp -72.32 -32.79 66.84 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.567 0.542 . . . . 0.0 110.252 -172.426 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.795 ' O ' ' HG2' ' A' 1002 ' ' MET . 37.6 mm -63.5 -56.29 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 122.678 1.227 . . . . 0.0 107.931 173.992 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.715 ' O ' ' HB2' ' A' 1004 ' ' LEU . 43.0 t30 -58.22 -13.5 5.18 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 113.825 -1.534 . . . . 0.0 112.458 172.047 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.83 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 71.5 mmtt -87.24 -40.42 14.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.223 0.919 . . . . 0.0 111.081 172.84 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.795 ' HG2' ' O ' ' A' ' 999' ' ' ILE . 12.0 ptt? -61.89 -34.67 76.45 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.543 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.742 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.6 ttmt -70.91 -57.98 4.05 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 113.844 -1.525 . . . . 0.0 108.556 172.62 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' A' 1000 ' ' ASN . 2.9 tt -48.33 -57.88 5.38 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.714 0.634 . . . . 0.0 111.589 -173.659 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.407 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -60.1 -48.37 81.99 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.078 0.466 . . . . 0.0 110.562 -175.456 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.632 ' NE2' ' HA ' ' A' ' 948' ' ' PRO . 10.7 mm100 -79.11 -15.32 58.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.112 -176.451 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.742 ' HB2' ' O ' ' A' 1003 ' ' LYS . 15.6 tp60 -87.09 -37.94 16.94 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.417 177.851 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.484 ' HD2' ' CG ' ' A' 1017 ' ' TYR . 19.7 t80 . . . . . 0 C--N 1.313 -0.987 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.854 -176.428 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.436 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 0.4 OUTLIER . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.577 ' OE1' ' HD3' ' A' 1018 ' ' LYS . 6.0 tp-100 -51.37 -35.38 38.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.584 -177.077 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' 1019 ' ' LYS . 2.6 tp10 -56.54 -59.62 4.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.338 0.589 . . . . 0.0 111.483 171.589 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.529 ' N ' ' CD1' ' A' 1017 ' ' TYR . 0.1 OUTLIER -50.06 -39.39 41.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.711 177.466 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.577 ' HD3' ' OE1' ' A' 1015 ' ' GLN . 86.4 tttt -60.98 -31.58 71.17 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.693 -1.14 . . . . 0.0 113.136 177.244 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' 1016 ' ' GLU . 89.8 mttt -58.5 -48.98 79.01 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.639 0.733 . . . . 0.0 109.23 177.028 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -51.96 -43.05 63.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.378 177.806 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.712 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 14.1 tmm? -65.12 -48.24 74.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.798 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.81 -32.85 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 -175.379 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 30.2 m -68.88 -47.06 66.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.081 0.467 . . . . 0.0 110.202 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.732 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -64.51 -35.62 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.271 177.888 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.786 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -60.87 -42.1 97.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.131 0.491 . . . . 0.0 110.446 176.132 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.572 ' O ' HG23 ' A' 1030 ' ' VAL . 58.1 t60 -69.14 -33.16 73.01 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.138 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.37 -46.92 84.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.119 176.486 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.567 HD13 ' N ' ' A' ' 995' ' ' LEU . 17.9 tp -59.72 -47.2 86.59 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.268 0.556 . . . . 0.0 110.27 177.206 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -54.69 -32.33 59.28 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.258 174.308 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 1026 ' ' HIS . 89.9 t -72.46 -40.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 122.076 -0.39 . . . . 0.0 110.546 172.86 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.637 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 28.0 m-20 -57.7 -47.16 83.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.697 173.854 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' 1036 ' ' LEU . . . -52.74 -39.45 62.16 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.292 169.503 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' 1036 ' ' LEU . 35.2 tttm -71.93 -35.08 69.53 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.375 -176.609 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.593 ' O ' HG23 ' A' 1038 ' ' VAL . 2.1 t-20 -70.8 -54.51 11.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 -178.831 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.832 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 15.2 tp -64.02 -28.35 69.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.738 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' 1040 ' ' ASP . 55.1 tp -51.37 -44.35 62.08 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.685 174.03 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.61 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 19.4 t70 -91.45 -26.92 18.61 Favored 'General case' 0 C--O 1.22 -0.461 0 O-C-N 124.105 0.878 . . . . 0.0 110.692 -179.345 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.832 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 25.2 t -57.42 -57.46 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 123.12 0.568 . . . . 0.0 111.967 177.04 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.728 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.9 pt -86.92 -27.37 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.947 -178.11 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.61 ' HB3' ' HA ' ' A' 1037 ' ' ASP . 2.4 t70 -44.21 -48.38 9.32 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 157.617 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.675 ' HA ' ' HB3' ' A' 1044 ' ' LEU . 23.4 tt0 -78.23 -23.84 47.24 Favored 'General case' 0 C--O 1.192 -1.936 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.494 176.428 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.851 ' O ' ' HG3' ' A' 1045 ' ' LYS . . . -56.29 -47.36 78.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.619 0.723 . . . . 0.0 111.504 175.632 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.845 ' HG2' HG21 ' A' ' 925' ' ' VAL . 5.9 mmm180 -79.46 -23.68 42.91 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.469 -0.769 . . . . 0.0 110.917 177.11 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.0 tp -78.38 -29.2 47.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.096 0.474 . . . . 0.0 110.498 175.474 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.999 ' HD3' ' HB2' ' A' ' 979' ' ' SER . 0.1 OUTLIER -71.42 -25.7 62.44 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 176.518 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 59.7 ttp -73.89 -28.69 61.68 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.603 175.741 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' 1044 ' ' LEU . 45.0 mm -69.89 -32.8 53.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 168.232 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.739 ' HB2' ' O ' ' A' 1045 ' ' LYS . 44.0 m -57.56 -23.75 52.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.245 172.541 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 . . . . . 0 C--N 1.329 -0.306 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.128 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.788 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 21.1 tpt180 . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 47.9 m -61.22 126.55 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 164.365 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.509 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.1 OUTLIER -64.29 84.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.529 0.681 . . . . 0.0 112.475 -170.599 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.1 t70 -47.04 -174.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.75 -174.902 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.48 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.9 tmtm? -36.03 -27.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.146 0.978 . . . . 0.0 111.96 -179.869 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.876 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 3.3 m -55.32 -53.64 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-O 119.16 -0.448 . . . . 0.0 112.049 175.19 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 23.5 t80 -75.74 -33.92 60.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.634 -174.091 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -46.36 75.53 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.585 -173.945 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.48 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 4.1 t30 -73.97 -38.99 64.01 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.677 -174.779 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.624 HG22 ' CD2' ' A' ' 965' ' ' LEU . 12.0 t -65.24 -33.62 64.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.403 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.485 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 3.9 p -72.73 -27.44 62.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 171.095 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 931' ' ' GLY . . . . . 0.427 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -60.78 -30.61 73.15 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.342 167.981 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.813 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -62.86 -38.2 89.89 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 174.901 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.565 ' HA ' HG12 ' A' ' 936' ' ' VAL . 70.3 t -65.27 -41.37 91.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.495 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.587 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.2 mmpt? -60.72 -33.69 73.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.013 0.435 . . . . 0.0 110.284 177.458 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.719 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -78.97 -26.21 43.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.562 -178.944 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 958' ' ' VAL . 12.9 p -82.87 -12.05 12.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.792 0.806 . . . . 0.0 109.334 171.72 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 59.2 mt -70.55 -41.26 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.092 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.648 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 56.5 mm-40 -53.74 -43.09 68.85 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.038 169.747 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.591 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 24.7 ttt -58.29 -41.15 83.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.562 177.881 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.701 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 40.6 m -67.83 -41.23 83.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.923 -179.764 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.517 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 11.8 p -76.39 -40.62 50.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -175.104 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.644 ' HB3' ' HB2' ' A' ' 954' ' ' MET . 7.8 mmtp -53.63 -49.58 67.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.126 178.829 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.586 HD12 ' HE1' ' A' ' 954' ' ' MET . 17.5 tt -71.28 -27.75 30.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.785 -173.437 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.809 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 91.9 mt-30 -56.42 -63.21 3.66 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.42 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.809 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.6 Cg_endo -97.34 -12.12 0.49 Allowed 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.451 1.434 . . . . 0.0 114.378 -175.333 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -95.86 152.28 38.92 Favored Pre-proline 0 C--N 1.323 -0.573 0 O-C-N 122.073 -0.392 . . . . 0.0 112.007 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 2.8 Cg_exo -76.89 178.7 7.29 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.584 2.856 . . . . 0.0 112.432 -178.212 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.721 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 50.0 Cg_exo -55.88 -27.32 62.37 Favored 'Trans proline' 0 C--O 1.245 0.852 0 C-N-CA 122.821 2.347 . . . . 0.0 112.561 176.233 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -55.73 -27.45 50.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.047 173.987 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.484 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.7 OUTLIER -102.03 -5.1 24.97 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.342 175.782 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.721 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 6.8 m-30 -56.45 -43.71 79.76 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.515 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.108 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -74.68 -51.8 3.87 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 119.97 -0.692 . . . . 0.0 112.159 176.689 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.86 -32.89 48.8 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.167 1.911 . . . . 0.0 113.972 173.632 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.644 ' HB2' ' HB3' ' A' ' 942' ' ' LYS . 0.0 OUTLIER -60.02 -54.91 40.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.878 0.847 . . . . 0.0 110.633 178.553 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.826 ' HB ' ' HB3' ' A' 1002 ' ' MET . 94.2 t -63.22 -26.5 41.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.151 172.539 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 19.2 tptm -65.01 -27.26 68.7 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.046 177.964 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -59.33 -46.51 88.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.308 172.057 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.856 HG21 HD23 ' A' ' 998' ' ' LEU . 2.5 m -72.29 -24.08 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.24 175.869 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.02 -43.51 57.16 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.265 -0.969 . . . . 0.0 111.141 176.521 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.88 -33.16 68.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.246 170.263 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.813 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.86 -56.48 21.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.32 179.841 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 991' ' ' LEU . 6.9 tt -71.43 -31.62 67.43 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.506 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.07 -55.51 34.04 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.815 -0.553 . . . . 0.0 111.148 171.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 m -58.78 -33.02 69.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.525 0.679 . . . . 0.0 110.339 174.471 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.647 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 1.8 tm? -63.53 -34.12 77.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.291 174.512 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 35.6 tp -62.46 -25.81 68.18 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.348 178.536 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.96 -43.05 84.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.175 0.512 . . . . 0.0 110.085 171.338 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.674 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 6.9 m -61.89 -37.44 84.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.294 173.82 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 965' ' ' LEU . 97.5 t -58.14 -31.25 41.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.115 174.457 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.47 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 22.0 t70 -76.79 -23.61 52.88 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.067 0.46 . . . . 0.0 110.824 178.405 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 63.8 mm-40 -70.52 -53.71 15.07 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.379 1.085 . . . . 0.0 108.839 169.7 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.716 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.8 t -66.95 -25.95 66.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.149 -178.479 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 57.3 tp -62.59 -53.21 59.15 Favored Pre-proline 0 C--O 1.218 -0.595 0 CA-C-O 118.863 -0.589 . . . . 0.0 112.297 -176.875 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.1 Cg_exo -54.86 -32.22 76.48 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 120.928 1.367 . . . . 0.0 111.297 169.193 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.8 t -77.46 -10.47 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.591 177.384 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.739 ' HG ' ' CB ' ' A' ' 981' ' ' HIS . 2.3 tt -65.59 -53.2 38.84 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.182 176.761 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.623 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 37.6 Cg_exo -61.87 -33.55 84.17 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.353 1.369 . . . . 0.0 110.842 173.985 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.96 27.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.918 175.93 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.844 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 8.7 m -170.73 -26.95 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -177.601 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.718 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 37.2 m -63.2 -20.92 65.86 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 -170.613 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.739 ' CB ' ' HG ' ' A' ' 976' ' ' LEU . 1.8 p80 -50.79 -21.91 1.89 Allowed 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -171.72 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -69.2 -54.5 14.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 119.883 -0.727 . . . . 0.0 110.535 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 1.018 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.99 -43.07 30.66 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.662 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.6 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.6 tp -60.23 -29.14 43.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.512 -175.031 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.37 -36.67 63.57 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.426 172.417 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.6 ptm -68.92 -52.73 26.3 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.991 -175.767 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.678 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.19 -46.22 21.05 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.487 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' A' ' 991' ' ' LEU . 23.2 tp60 -60.64 -37.56 81.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.291 -175.126 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -59.6 -41.94 91.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.737 0.78 . . . . 0.0 109.173 174.796 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 987' ' ' ALA . 0.1 OUTLIER -72.77 -35.68 67.5 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.973 179.417 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 1.034 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.0 mt -60.72 -50.13 74.71 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.626 0.727 . . . . 0.0 109.837 179.164 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -56.67 -41.87 78.01 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.235 -175.127 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 11.5 p -75.54 -33.2 60.66 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -178.248 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.09 -41.87 10.26 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -171.327 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.6 OUTLIER -59.56 -39.11 82.95 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 171.141 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -54.86 -48.93 72.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.771 178.251 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 993' ' ' SER . 62.6 mm-40 -57.61 -38.93 75.76 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.373 179.434 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.856 HD23 HG21 ' A' ' 958' ' ' VAL . 14.9 tp -70.39 -29.8 66.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.089 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.506 ' O ' ' HG2' ' A' 1002 ' ' MET . 44.4 mt -61.82 -35.75 69.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.893 173.506 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.653 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 41.9 m-80 -88.42 -5.5 58.23 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.101 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 5.2 mptp? -86.19 -34.64 20.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 174.687 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.108 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.9 ptt? -73.47 -35.95 65.77 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 171.978 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.774 ' O ' ' HB2' ' A' 1007 ' ' GLN . 87.3 tttt -62.27 -56.89 14.1 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.213 174.663 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.636 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.0 mp -64.97 -35.79 82.33 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 178.768 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -63.31 -47.36 82.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.899 0.857 . . . . 0.0 109.851 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -8.4 56.88 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.196 177.312 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.774 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.0 tp-100 -90.42 -21.18 22.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.397 178.561 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 77.9 t80 . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.807 -174.876 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.224 -0.254 0 CA-C-O 120.77 0.319 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' A' 1019 ' ' LYS . 27.3 pt20 -55.32 -33.9 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.561 -176.412 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.6 tt0 -50.19 -49.17 53.39 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 170.893 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1017 ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -80.04 -14.6 58.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 179.228 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.8 tttp -68.63 -36.19 78.28 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 171.017 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' 1015 ' ' GLN . 32.5 mmtp -68.67 -55.26 12.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.457 176.396 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' 1016 ' ' GLU . 49.5 mm-40 -48.37 -38.42 19.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.849 173.11 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.469 ' HB3' ' O ' ' A' 1018 ' ' LYS . 37.8 ttm -58.79 -57.47 12.86 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 176.346 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.49 -34.97 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -179.588 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 61.8 m -60.71 -40.17 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.873 177.863 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.419 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -78.69 -31.28 46.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.507 179.201 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.552 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.15 -41.12 95.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.2 176.348 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.646 ' O ' HG23 ' A' 1030 ' ' VAL . 12.8 t-80 -63.84 -40.0 95.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.949 174.177 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -65.87 -45.94 80.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.07 -179.599 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.1 -28.77 64.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.504 0.668 . . . . 0.0 110.232 178.204 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.479 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.63 -41.43 85.94 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.682 -0.636 . . . . 0.0 109.694 171.483 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' 1026 ' ' HIS . 48.1 t -59.95 -30.75 46.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.468 174.167 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.492 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -76.5 -40.93 48.76 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 109.804 178.723 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.45 -52.64 64.77 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 121.252 0.549 . . . . 0.0 110.718 175.908 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.59 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 19.7 pttp -65.89 -32.18 73.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -172.055 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.527 ' O ' HG23 ' A' 1038 ' ' VAL . 64.9 t30 -73.6 -35.69 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.139 179.551 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.763 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -76.33 -32.5 58.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 -178.154 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.858 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.4 pp -66.54 -23.61 66.25 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.27 -39.53 25.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.566 169.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1038 ' ' VAL . . . . . 1.018 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -53.58 -65.41 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.117 -0.947 . . . . 0.0 112.792 175.955 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.876 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -74.86 -27.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.348 -177.028 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.739 ' H ' HD12 ' A' 1039 ' ' ILE . 11.7 t70 -50.35 -45.56 55.18 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.268 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.732 ' O ' ' HG2' ' A' 1045 ' ' LYS . 47.6 mt-30 -76.75 -28.69 55.84 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.031 176.017 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.657 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.84 -55.98 19.15 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.973 0.806 . . . . 0.0 111.729 176.536 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.788 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 1.4 mpt_? -58.49 -31.37 67.8 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.924 174.433 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.1 tp -76.38 -20.91 56.7 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.848 175.261 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.844 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.2 mmtt -67.41 -32.66 73.71 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.151 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 15.5 tmm? -69.12 -37.43 78.34 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.795 176.547 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.499 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 49.2 mm -65.47 -37.77 80.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.919 172.82 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.3 m -58.07 -42.62 85.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.721 177.492 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.852 178.594 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.433 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 15.0 tpt180 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 28.1 t -85.04 84.37 7.74 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.616 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -11.61 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.065 1.746 . . . . 0.0 114.114 -175.459 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.885 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 2.2 t0 -47.22 -173.4 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 112.552 -2.113 . . . . 0.0 113.275 -174.238 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.4 tmtp? -37.25 -24.7 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.922 -1.035 . . . . 0.0 112.209 177.594 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.849 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.3 m -56.45 -52.15 56.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 122.615 0.366 . . . . 0.0 111.899 172.955 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.553 ' HD1' ' CD2' ' A' 1036 ' ' LEU . 4.8 t80 -68.88 -29.58 67.9 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -178.173 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 6.3 mm-40 -68.39 -65.55 0.68 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.092 -1.413 . . . . 0.0 113.374 -173.881 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.685 HD21 ' HB ' ' A' ' 968' ' ' THR . 22.0 p-10 -73.24 -30.73 63.67 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.503 -172.556 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.654 HG22 ' CD1' ' A' ' 965' ' ' LEU . 45.9 t -64.02 -37.15 79.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.335 177.204 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.557 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 12.2 p -73.28 -28.02 61.88 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 171.275 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 931' ' ' GLY . . . . . 0.516 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -58.52 -28.27 62.15 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 114.699 -1.137 . . . . 0.0 112.546 169.18 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.689 ' HG ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -66.02 -44.58 84.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.943 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.552 ' O ' HG12 ' A' ' 937' ' ' ILE . 66.1 t -57.81 -38.06 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.588 172.193 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 930' ' ' THR . 9.8 mmpt? -62.96 -36.12 82.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 175.738 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.666 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.94 -25.81 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.642 -179.026 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 14.5 p -81.6 -16.41 12.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.558 172.781 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 933' ' ' VAL . 47.6 mm -69.26 -37.48 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 165.935 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.2 mm-40 -53.87 -37.38 63.63 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.704 171.367 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.666 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 59.6 ttp -58.87 -45.65 89.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 31.8 m -71.87 -28.62 63.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 178.602 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.616 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.0 m -77.36 -41.17 41.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.138 0.971 . . . . 0.0 108.391 -176.48 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.8 mmtp -59.22 -42.07 90.13 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 113.532 -1.667 . . . . 0.0 111.955 179.318 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.457 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.6 tt -71.66 -24.55 23.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.065 -176.168 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.782 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 76.4 mt-30 -55.82 -62.68 4.2 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.782 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -100.49 12.25 0.52 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.749 1.633 . . . . 0.0 114.26 -176.103 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -131.47 155.24 81.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.775 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.726 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.3 Cg_endo -93.21 -169.37 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 123.886 3.058 . . . . 0.0 112.701 -177.304 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.726 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 94.7 Cg_exo -49.51 -32.8 28.4 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.282 2.655 . . . . 0.0 113.559 176.464 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.541 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 73.4 mm-40 -53.63 -20.9 5.83 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.917 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.533 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.4 OUTLIER -118.73 -6.86 10.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.565 -178.591 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.758 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.9 m-85 -55.98 -48.55 75.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.136 0.494 . . . . 0.0 109.951 175.139 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.055 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.09 -44.69 3.75 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 119.106 -1.037 . . . . 0.0 111.702 176.829 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.055 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.4 Cg_exo -55.16 -27.98 58.83 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.597 2.198 . . . . 0.0 115.462 172.28 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.758 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 18.6 ptp -69.33 -44.78 70.97 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.182 0.991 . . . . 0.0 108.764 175.853 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.776 ' CG1' ' HA ' ' A' ' 999' ' ' ILE . 59.4 t -59.91 -27.66 39.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.912 169.547 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.512 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 27.6 ttpt -66.39 -33.13 75.02 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.684 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.06 -45.46 79.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.573 175.691 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.8 m -70.51 -24.99 26.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.266 175.293 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.39 -43.79 36.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.824 177.786 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.9 -24.87 68.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.088 0.471 . . . . 0.0 109.903 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.689 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -65.57 -49.8 67.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.334 173.307 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.876 ' HB2' ' HG ' ' A' ' 995' ' ' LEU . 18.0 tp -59.83 -40.71 89.37 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 172.997 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -54.87 -55.58 28.89 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.001 0.429 . . . . 0.0 111.15 172.323 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 44.0 m -55.67 -42.44 75.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.723 0.773 . . . . 0.0 110.43 174.798 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.663 HD21 HD22 ' A' ' 991' ' ' LEU . 9.9 tp -54.53 -40.13 68.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.834 176.248 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.403 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 9.6 tt -59.85 -33.38 71.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.77 -178.645 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.68 86.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.104 0.478 . . . . 0.0 110.261 175.353 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.843 HG23 HG12 ' A' ' 925' ' ' VAL . 0.8 OUTLIER -70.65 -34.05 71.63 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.825 175.401 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 98.7 t -55.81 -30.28 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 173.943 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.6 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 24.2 t70 -80.85 -29.52 35.81 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 177.825 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.3 mm-40 -69.41 -42.82 74.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 123.114 1.435 . . . . 0.0 108.186 171.167 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 972' ' ' SER . . . . . 1.018 ' HA ' HG22 ' A' ' 975' ' ' VAL . 33.2 t -68.01 -22.73 64.97 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 113.29 -1.777 . . . . 0.0 111.673 174.515 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.5 tt -58.45 -53.46 65.91 Favored Pre-proline 0 C--O 1.213 -0.854 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.082 179.199 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 43.5 Cg_exo -59.73 -34.72 95.99 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-N 121.419 1.542 . . . . 0.0 111.911 173.178 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 1.018 HG22 ' HA ' ' A' ' 972' ' ' SER . 19.7 m -77.23 -10.12 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 118.975 -1.09 . . . . 0.0 111.306 -178.613 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.905 ' HA ' ' HB ' ' A' ' 980' ' ' THR . 3.3 pp -81.98 -40.16 0.95 Allowed Pre-proline 0 CA--C 1.537 0.479 0 CA-C-O 118.307 -0.854 . . . . 0.0 113.187 -177.208 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.477 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 44.1 Cg_endo -69.89 -27.22 26.1 Favored 'Trans proline' 0 C--N 1.36 1.177 0 CA-C-N 121.669 1.632 . . . . 0.0 109.662 172.222 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.26 9.19 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.554 172.336 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 18.4 m -167.94 -6.55 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.444 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.905 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 88.2 m -88.07 -23.24 23.79 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -169.643 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.583 ' HA ' HG22 ' A' ' 984' ' ' ILE . 19.8 t60 -50.72 -34.93 28.84 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.002 0.819 . . . . 0.0 111.435 -172.973 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -59.78 -52.95 63.26 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.738 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.717 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.1 tp10 -74.71 -47.95 28.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.92 -178.597 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.744 ' HA ' HG11 ' A' 1038 ' ' VAL . 8.4 tp -54.84 -38.77 45.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -173.261 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.427 ' OE1' ' HA ' ' A' ' 985' ' ' GLU . 5.2 mm-40 -73.13 -27.7 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.881 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.617 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 11.1 ptt? -63.5 -50.52 69.31 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.136 178.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.585 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.29 -42.63 22.73 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.745 -178.601 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.422 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -61.59 -42.34 98.72 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.028 -173.306 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 989' ' ' LYS . 11.0 tmtt? -65.55 -41.39 93.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 175.646 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.76 -50.48 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.167 177.875 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.663 HD22 HD21 ' A' ' 965' ' ' LEU . 2.9 pp -74.55 -29.32 61.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.761 0.315 . . . . 0.0 111.441 -175.232 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.484 ' N ' HD12 ' A' ' 991' ' ' LEU . 26.7 t-20 -58.14 -43.38 87.29 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.478 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.5 m -76.34 -27.34 56.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.193 -174.249 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -103.98 -44.76 4.93 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -170.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.011 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.77 -50.18 71.14 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.157 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.603 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -57.51 -45.69 84.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.825 176.796 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.73 -35.38 77.9 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 1.2 tm? -72.3 -36.21 68.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.903 -174.124 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.776 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 28.7 pt -65.45 -27.05 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.208 0.528 . . . . 0.0 110.46 177.226 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.605 ' O ' ' HB2' ' A' 1004 ' ' LEU . 53.2 m-80 -93.35 -6.14 47.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.692 175.737 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.67 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 20.9 tptt -85.31 -46.83 10.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -175.797 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.703 ' HB3' HG21 ' A' ' 955' ' ' VAL . 56.9 tpp -79.85 -32.91 40.51 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.36 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 41.7 ttmt -55.28 -49.06 73.06 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.118 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.605 ' HB2' ' O ' ' A' 1000 ' ' ASN . 28.9 tp -53.86 -50.9 65.24 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.901 0.751 . . . . 0.0 112.293 171.288 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.465 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -58.48 -46.45 86.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.251 0.548 . . . . 0.0 110.979 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.528 ' OE1' ' HB3' ' A' ' 948' ' ' PRO . 20.6 mm-40 -77.43 -7.61 56.44 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.314 178.286 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.2 tp-100 -89.82 -9.41 49.27 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.136 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 57.1 t80 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.068 -178.818 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.809 0.338 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 13.5 pt20 -67.81 -21.82 65.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.822 -175.033 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' 1019 ' ' LYS . 25.8 tt0 -57.89 -55.63 32.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.422 0.629 . . . . 0.0 109.521 174.967 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.487 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 5.7 m-30 -74.94 -15.17 60.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.1 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.585 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 39.3 ttpt -78.19 -42.53 31.19 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.154 -0.219 . . . . 0.0 110.582 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' 1016 ' ' GLU . 17.2 ptpt -69.04 -20.86 64.13 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.615 0.721 . . . . 0.0 109.405 176.569 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.411 ' HG2' ' HE3' ' A' 1001 ' ' LYS . 34.3 tt0 -78.64 -42.74 27.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.086 177.706 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.478 ' HG3' ' HA ' ' A' 1018 ' ' LYS . 3.6 ppp? -74.91 -27.13 60.09 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.38 178.876 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.1 tp -63.56 -44.09 95.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.159 0.504 . . . . 0.0 110.21 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.1 m -65.87 -31.13 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.575 177.6 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.85 -35.16 44.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.508 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.17 -31.49 72.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.264 177.146 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.493 ' O ' HG23 ' A' 1030 ' ' VAL . 31.0 t60 -67.51 -34.05 76.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.772 174.919 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -75.76 -41.65 52.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.164 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.011 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.49 -32.05 67.81 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.337 0.589 . . . . 0.0 110.605 179.953 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.611 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.65 -38.67 72.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.142 0.496 . . . . 0.0 110.314 171.875 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' 1026 ' ' HIS . 96.2 t -65.81 -34.2 68.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.052 174.594 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.6 p30 -72.76 -39.86 66.48 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.858 -172.546 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.546 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -61.05 -54.31 46.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.084 0.468 . . . . 0.0 110.444 174.459 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.413 ' HA ' ' HB3' ' A' 1036 ' ' LEU . 20.0 ttpt -71.74 -22.89 61.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.372 -173.291 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.473 ' O ' HG23 ' A' 1038 ' ' VAL . 19.9 t-20 -73.94 -32.32 63.45 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.168 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 984' ' ' ILE . 19.6 tp -76.46 -33.61 58.72 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.659 ' HA ' HD11 ' A' 1039 ' ' ILE . 0.0 OUTLIER -48.24 -42.56 30.71 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 174.733 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.636 ' N ' HD13 ' A' 1036 ' ' LEU . 23.1 t70 -72.39 -45.3 60.36 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.174 0.511 . . . . 0.0 110.057 177.147 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.744 HG11 ' HA ' ' A' ' 984' ' ' ILE . 40.8 t -48.32 -63.55 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.684 175.673 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.849 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -78.77 -29.01 14.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.098 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.734 ' H ' HD12 ' A' 1039 ' ' ILE . 1.0 OUTLIER -50.53 -48.49 57.19 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 166.09 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.748 ' O ' ' HG2' ' A' 1045 ' ' LYS . 94.5 mt-30 -74.78 -32.49 62.05 Favored 'General case' 0 C--O 1.2 -1.544 0 CA-C-N 113.413 -1.721 . . . . 0.0 111.22 175.592 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.778 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.28 -55.45 21.28 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 118.763 0.711 . . . . 0.0 112.109 178.778 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.885 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 4.0 tpt180 -54.65 -35.95 64.05 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.418 174.296 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.92 -26.17 59.43 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.297 175.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 73.2 mmtt -65.39 -32.79 74.6 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.701 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1046 ' ' MET . . . . . 0.44 ' HB2' HG12 ' A' ' 975' ' ' VAL . 1.7 tmt? -64.45 -40.02 94.93 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.811 175.759 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.11 -37.15 79.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.954 172.389 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A 1048 ' ' SER . . . . . 0.435 ' HB3' ' O ' ' A' 1045 ' ' LYS . 33.2 t -59.19 -37.52 77.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.107 0.48 . . . . 0.0 110.533 177.026 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 23.0 tm0? . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.302 178.835 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 920' ' ' ARG . . . . . 0.778 ' CD ' ' HB2' ' A' 1044 ' ' LEU . 4.1 ttt-85 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 33.5 m 60.31 15.36 5.33 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.868 0.467 . . . . 0.0 111.923 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 922' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 43.06 52.46 5.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 123.522 0.729 . . . . 0.0 110.845 -174.479 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 923' ' ' ASP . . . . . 0.477 ' O ' ' N ' ' A' ' 925' ' ' VAL . 23.5 t0 -46.56 -175.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 O-C-N 125.638 1.837 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.651 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.9 tmtm? -34.33 -25.23 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.032 0.933 . . . . 0.0 112.46 178.523 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.755 ' HA ' HG21 ' A' ' 968' ' ' THR . 4.5 m -56.52 -50.66 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 174.028 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' A' 1036 ' ' LEU . 27.2 t80 -76.94 -35.41 57.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -177.476 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.64 -53.65 54.93 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.607 -1.633 . . . . 0.0 111.546 -177.001 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.18 -44.99 86.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.203 -173.969 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.909 ' HB ' HD23 ' A' 1036 ' ' LEU . 16.6 t -60.92 -34.84 61.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.076 -0.649 . . . . 0.0 111.217 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.656 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 87.6 m -60.67 -39.37 88.15 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 173.137 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.61 70.01 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 114.982 -1.008 . . . . 0.0 113.318 174.131 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.909 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 10.8 tp -68.41 -35.0 77.01 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 109.51 176.361 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 936' ' ' VAL . 45.9 t -70.33 -38.56 74.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.3 0.571 . . . . 0.0 110.028 172.359 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.656 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -64.29 -25.35 68.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.462 177.23 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.597 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -75.37 -29.96 60.04 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.257 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 10.2 p -79.7 -13.67 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.043 173.29 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 47.0 mm -73.37 -42.48 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 166.202 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.534 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.2 mm-40 -52.6 -41.94 64.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.222 169.273 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.545 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 14.4 ttt -59.09 -41.06 87.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.895 177.756 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.61 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 19.9 m -66.25 -37.07 84.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 941' ' ' SER . . . . . 0.506 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.1 m -77.67 -40.36 41.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -176.787 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 942' ' ' LYS . . . . . 0.704 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.6 mmtp -62.95 -40.02 96.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.457 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 943' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' A' ' 946' ' ' ALA . 9.5 tp -73.98 -23.19 18.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 O-C-N 123.127 0.267 . . . . 0.0 111.216 -177.831 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 944' ' ' GLN . . . . . 0.667 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 77.6 mt-30 -53.52 -54.09 49.52 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.706 177.799 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 945' ' ' PRO . . . . . 0.667 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 63.1 Cg_endo -100.54 21.66 0.22 Allowed 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.999 1.799 . . . . 0.0 113.473 173.986 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 946' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 943' ' ' ILE . . . -89.21 128.57 51.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -173.289 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 947' ' ' PRO . . . . . 0.45 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 1.8 Cg_endo -84.99 179.2 4.32 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.465 2.777 . . . . 0.0 108.489 159.015 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 948' ' ' PRO . . . . . 0.584 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 7.1 Cg_endo -50.86 -34.64 46.02 Favored 'Trans proline' 0 C--O 1.245 0.829 0 C-N-CA 122.167 1.912 . . . . 0.0 111.731 178.061 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 949' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 17.8 mm-40 -55.6 -37.49 68.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.353 178.224 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 950' ' ' GLU . . . . . 0.547 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.8 mp0 -96.45 -5.55 39.36 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 178.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.584 ' CD1' ' HA ' ' A' ' 948' ' ' PRO . 10.6 m-85 -57.75 -42.12 83.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 172.713 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.016 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -71.79 -51.98 8.43 Favored Pre-proline 0 CA--C 1.555 1.14 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.246 177.168 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.016 ' HD3' HG13 ' A' ' 952' ' ' VAL . 96.8 Cg_exo -51.42 -41.06 61.4 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.734 2.29 . . . . 0.0 115.135 174.629 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.704 ' HB3' ' HB3' ' A' ' 942' ' ' LYS . 14.8 ptt? -60.21 -50.06 75.15 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.706 0.765 . . . . 0.0 110.093 -179.012 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' A' 1002 ' ' MET . 2.7 t -63.54 -26.82 41.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.785 174.302 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 39.1 ttmt -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.1 mm-40 -56.0 -46.96 78.58 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.45 174.911 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 1.018 HG23 HD22 ' A' ' 998' ' ' LEU . 3.1 m -68.66 -26.27 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.834 177.474 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.455 ' HA2' HD21 ' A' ' 998' ' ' LEU . . . -75.18 -44.11 23.92 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.061 -1.066 . . . . 0.0 112.58 -179.804 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.6 -25.03 64.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.912 0.387 . . . . 0.0 110.482 172.26 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.909 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.24 -52.98 59.94 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.069 174.645 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 1.021 ' HB2' HD23 ' A' ' 995' ' ' LEU . 18.0 tp -53.3 -44.92 68.7 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.055 0.389 . . . . 0.0 111.213 172.81 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 30.1 mmm180 -56.26 -54.87 40.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.954 0.407 . . . . 0.0 111.122 177.274 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.4 m -53.81 -43.21 69.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.464 0.65 . . . . 0.0 110.945 174.796 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.601 HD21 HD12 ' A' 1035 ' ' LEU . 36.6 tp -61.92 -37.11 83.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.598 179.157 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.0 tp -52.92 -36.56 59.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.182 178.097 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.06 95.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.151 0.5 . . . . 0.0 110.335 174.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 925' ' ' VAL . 5.7 m -66.46 -34.02 77.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 174.239 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.652 HG13 HD11 ' A' ' 984' ' ' ILE . 73.3 t -55.25 -31.72 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.509 172.781 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.627 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.9 t70 -76.63 -22.78 53.65 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.242 177.72 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.661 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 50.7 mm-40 -68.99 -50.79 45.9 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 122.972 1.368 . . . . 0.0 108.587 170.128 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.631 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.3 t -65.53 -24.93 67.24 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.34 177.914 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.69 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.3 tp -61.11 -48.87 90.83 Favored Pre-proline 0 C--O 1.217 -0.616 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.619 -176.319 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 32.3 Cg_exo -61.57 -27.98 82.45 Favored 'Trans proline' 0 C--N 1.355 0.876 0 CA-C-N 121.246 1.481 . . . . 0.0 110.578 170.24 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.6 t -76.86 -10.31 13.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.496 175.676 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 976' ' ' LEU . . . . . 0.69 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 3.7 tt -68.04 -53.82 18.36 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.226 176.303 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 977' ' ' PRO . . . . . 0.62 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.5 Cg_exo -62.9 -24.32 74.22 Favored 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 121.437 1.425 . . . . 0.0 111.054 174.36 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -56.83 11.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.585 172.886 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 4.7 m -169.02 -33.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.975 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.728 HG22 ' HB ' ' A' ' 984' ' ' ILE . 8.3 m -54.99 -19.57 7.11 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -174.695 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.611 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 83.5 t60 -48.5 -20.12 0.4 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.363 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 982' ' ' ARG . 23.6 ttt85 -77.4 -55.52 5.33 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.301 179.203 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.92 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.1 OUTLIER -79.57 -43.76 22.39 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.11 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.728 ' HB ' HG22 ' A' ' 980' ' ' THR . 7.9 tp -56.04 -37.86 50.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.796 -170.406 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 14.7 pt-20 -75.76 -40.71 54.84 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.146 177.034 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.731 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 13.8 ptp -61.25 -50.15 74.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.555 -173.918 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.6 -32.67 47.64 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.204 -177.737 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 984' ' ' ILE . 50.9 tt0 -62.38 -50.32 72.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.34 -179.887 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -65.16 -32.03 73.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.351 0.596 . . . . 0.0 109.935 175.386 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.3 tp -61.14 -58.86 6.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.353 176.611 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 3.1 pp -70.86 -19.05 62.68 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.447 -176.728 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 996' ' ' ALA . 6.7 t30 -59.61 -38.17 80.59 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 173.896 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 50.5 m -77.6 -30.47 52.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -178.832 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.649 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.4 m-20 -103.36 -27.49 12.4 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 119.629 -0.828 . . . . 0.0 112.4 -175.473 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.021 HD23 ' HB2' ' A' ' 962' ' ' LEU . 7.1 mp -71.8 -15.74 62.16 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 163.088 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 996' ' ' ALA . . . . . 0.604 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -68.88 -41.82 77.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.308 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 994' ' ' ASP . 7.8 mm-40 -58.26 -33.21 69.15 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.952 171.704 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 1.018 HD22 HG23 ' A' ' 958' ' ' VAL . 0.6 OUTLIER -58.33 -35.64 72.19 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.013 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.604 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 1.7 mp -60.24 -42.78 91.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.449 175.4 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.706 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 92.5 m-20 -77.69 -19.37 55.43 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.307 177.284 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.715 ' HD3' ' HA ' ' A' ' 998' ' ' LEU . 9.2 mtpm? -66.9 -44.53 80.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.165 0.507 . . . . 0.0 109.781 174.823 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.925 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 22.3 ptp -76.59 -36.38 57.57 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.681 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.789 ' O ' ' HB2' ' A' 1007 ' ' GLN . 23.4 tptm -67.5 -62.59 1.34 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.893 -179.335 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' 1017 ' ' TYR . 2.9 tt -52.19 -56.17 16.33 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.454 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.75 -53.59 56.14 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.301 -174.102 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -17.99 64.6 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.169 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.789 ' HB2' ' O ' ' A' 1003 ' ' LYS . 21.8 tp60 -88.56 -38.45 14.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.469 0.652 . . . . 0.0 110.755 -176.491 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.586 ' CD2' ' CE1' ' A' 1017 ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.313 -1.018 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.285 -172.476 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.431 ' OE1' ' HD2' ' A' 1017 ' ' TYR . 4.8 tp-100 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.725 0.774 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' 1018 ' ' LYS . 0.7 OUTLIER -65.54 -41.08 93.42 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.875 -179.473 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -50.22 -52.13 38.53 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.698 173.138 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.825 ' HB3' HD22 ' A' 1004 ' ' LEU . 0.9 OUTLIER -73.96 -19.44 60.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.343 0.592 . . . . 0.0 110.595 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' 1015 ' ' GLN . 23.1 tptm -71.34 -46.06 61.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.89 171.179 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -58.05 -56.42 22.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.159 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -47.94 -41.32 24.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.825 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.539 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 2.6 ptp -77.27 -23.34 51.2 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.998 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 67.3 tp -69.05 -39.76 78.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.143 0.497 . . . . 0.0 109.944 179.064 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 20.7 m -64.97 -33.75 76.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.05 175.362 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.34 -26.78 46.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.386 177.865 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.83 -37.08 73.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.193 177.927 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.492 ' O ' HG23 ' A' 1030 ' ' VAL . 20.3 t60 -66.6 -42.91 86.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.63 175.627 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.65 -51.2 68.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.115 178.944 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -64.75 -33.71 76.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.691 -179.089 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.587 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.06 -43.16 86.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.362 172.908 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' 1026 ' ' HIS . 96.0 t -67.35 -38.97 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 177.186 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.801 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 4.9 m-20 -61.24 -44.49 97.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.846 177.529 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.39 -57.04 12.82 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.964 0.412 . . . . 0.0 110.351 167.651 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' 1036 ' ' LEU . 84.9 mttt -66.22 -22.99 66.35 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -170.871 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' 1038 ' ' VAL . 66.8 t30 -73.34 -41.15 63.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.776 175.697 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.737 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tm? -75.56 -26.12 57.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.605 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.909 HD23 ' HB ' ' A' ' 929' ' ' VAL . 3.1 tm? -54.35 -52.04 62.86 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.198 169.575 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 18.9 t70 -72.34 -36.17 68.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.646 -178.694 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.92 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.3 t -51.69 -60.8 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.333 174.373 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.706 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 29.1 pt -89.83 -24.48 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -171.711 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -53.63 -48.25 69.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 162.84 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' A' 1045 ' ' LYS . 31.7 mt-30 -74.43 -21.65 59.51 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.248 176.366 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.706 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.94 -54.04 40.77 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 118.801 0.728 . . . . 0.0 110.625 171.567 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.703 ' HB3' ' HA ' ' A' ' 920' ' ' ARG . 3.3 mpt_? -53.17 -34.79 58.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 173.411 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.778 ' HB2' ' CD ' ' A' ' 920' ' ' ARG . 3.3 tm? -73.73 -34.13 64.64 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.296 173.82 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.8 mmtt -55.81 -28.31 55.63 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.529 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.4 ttm -72.12 -46.76 55.38 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.185 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1047 ' ' ILE . . . . . 0.44 ' HB ' HD22 ' A' 1044 ' ' LEU . 41.0 mm -64.69 -41.85 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.821 175.358 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 20.6 t -52.73 -41.58 64.1 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.301 175.782 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 25.1 tm0? . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.357 -178.766 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.626 ' CG ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.536 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 16.7 m -59.05 141.13 54.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 166.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.744 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.32 82.02 0.15 Allowed 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 122.313 0.245 . . . . 0.0 111.422 -174.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 925' ' ' VAL . 3.3 t70 -46.23 -174.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 O-C-N 126.028 2.08 . . . . 0.0 113.055 -170.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.2 tmtp? -42.97 -19.38 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.281 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.882 ' HA ' HG23 ' A' ' 968' ' ' THR . 2.3 m -60.15 -56.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.867 174.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 57.3 t80 -78.67 -25.03 44.82 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.425 1.107 . . . . 0.0 108.508 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 98.3 mt-10 -63.6 -62.82 1.42 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.799 -1.546 . . . . 0.0 111.807 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.42 -32.94 66.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.196 -0.456 . . . . 0.0 112.188 -171.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.819 HG21 HD11 ' A' 1039 ' ' ILE . 19.0 m -60.65 -36.47 70.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.727 0.299 . . . . 0.0 111.512 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.655 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.5 m -61.45 -36.9 81.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 171.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.95 63.24 Favored Glycine 0 CA--C 1.522 0.504 0 CA-C-N 114.558 -1.201 . . . . 0.0 113.279 175.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 1.07 HD12 HD22 ' A' ' 965' ' ' LEU . 3.1 tt -63.86 -50.74 67.64 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.514 ' O ' HG22 ' A' ' 936' ' ' VAL . 39.4 t -58.51 -42.02 83.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.083 0.468 . . . . 0.0 110.316 178.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.655 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -63.19 -28.81 70.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.115 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.564 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . . . -79.37 -25.45 42.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.466 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 0.9 OUTLIER -78.75 -14.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.227 173.814 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.504 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 70.3 mt -69.59 -35.31 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 168.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 13.7 mm-40 -54.59 -38.43 66.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.284 171.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.905 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 44.4 ttm -58.02 -43.36 86.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.144 0.497 . . . . 0.0 110.04 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 14.0 m -68.33 -39.95 81.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.043 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.544 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 17.2 p -76.93 -35.94 56.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -173.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 7.4 mmtp -54.78 -47.92 73.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.516 -1.22 . . . . 0.0 112.147 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.547 ' HB ' ' CE ' ' A' ' 954' ' ' MET . 10.8 tt -71.24 -24.37 24.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.435 -174.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.714 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 85.1 mt-30 -57.52 -57.88 22.14 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.9 Cg_endo -96.2 -16.31 0.38 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.46 1.44 . . . . 0.0 114.124 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -103.35 158.33 32.03 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -171.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.779 ' HG2' ' HG2' ' A' ' 949' ' ' GLU . 84.0 Cg_endo -92.31 -174.97 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 123.804 3.003 . . . . 0.0 113.155 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.628 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 81.7 Cg_exo -49.83 -31.64 27.05 Favored 'Trans proline' 0 C--N 1.363 1.291 0 C-N-CA 123.719 2.946 . . . . 0.0 114.885 -178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.779 ' HG2' ' HG2' ' A' ' 947' ' ' PRO . 11.7 pt-20 -55.48 -29.5 58.88 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.634 176.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 51.0 mm-40 -98.14 -5.54 33.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.604 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.779 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.8 m-85 -55.0 -46.08 75.12 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.994 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -70.1 -51.96 13.36 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 119.267 -0.973 . . . . 0.0 112.324 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.994 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.9 Cg_exo -53.04 -31.98 56.32 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.731 2.287 . . . . 0.0 115.158 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.905 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.7 ptp -64.8 -39.83 94.23 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.021 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.636 ' O ' HG22 ' A' ' 958' ' ' VAL . 65.7 t -67.12 -28.01 41.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.917 169.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.9 tptm -65.25 -33.82 76.89 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.6 mm-40 -56.31 -47.38 78.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.971 174.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 955' ' ' VAL . 3.2 m -70.36 -25.15 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.437 174.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.734 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.03 -45.81 61.28 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.083 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.425 ' O ' HD13 ' A' ' 960' ' ' LEU . 2.3 tm? -62.35 -30.49 71.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.961 0.41 . . . . 0.0 109.917 171.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.734 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.18 -57.01 14.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.072 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.946 ' HB2' HD13 ' A' ' 995' ' ' LEU . 2.9 tm? -60.55 -40.62 92.22 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.578 177.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -50.39 -56.59 10.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.555 0.693 . . . . 0.0 110.894 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.9 m -53.35 -40.51 64.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.238 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 1.07 HD22 HD12 ' A' ' 932' ' ' LEU . 6.3 mp -68.3 -27.22 66.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.523 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.8 tt -56.96 -36.13 69.94 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.53 97.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.284 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.882 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -62.23 -41.4 98.37 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.809 173.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 965' ' ' LEU . 87.9 t -55.11 -31.85 26.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.927 174.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.9 t70 -75.84 -34.09 60.08 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.129 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.578 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.8 mm-40 -59.73 -53.13 61.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.515 1.15 . . . . 0.0 108.762 172.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.463 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.0 t -67.57 -22.3 65.4 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.756 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.716 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 28.7 tp -53.3 -55.62 32.57 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 118.579 -0.725 . . . . 0.0 112.144 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.716 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 35.4 Cg_exo -63.8 -23.8 68.8 Favored 'Trans proline' 0 C--N 1.358 1.069 0 CA-C-N 121.127 1.438 . . . . 0.0 111.02 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.532 HG13 ' HB2' ' A' 1046 ' ' MET . 11.5 t -77.51 -8.62 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.162 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.622 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -83.47 -40.14 0.77 Allowed Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.363 -0.836 . . . . 0.0 111.951 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.622 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 18.3 Cg_endo -63.99 -23.91 67.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 120.797 1.321 . . . . 0.0 110.133 168.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 975' ' ' VAL . . . -64.87 -62.68 1.42 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.148 169.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.867 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.4 m -165.76 -32.31 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.687 HG22 ' HB ' ' A' ' 984' ' ' ILE . 3.4 m -57.27 -18.22 15.47 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.649 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.0 p-80 -48.71 -20.75 0.5 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -174.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -70.97 -57.41 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.486 177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.951 ' HG2' HG22 ' A' 1038 ' ' VAL . 0.0 OUTLIER -82.91 -34.5 26.61 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -178.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.687 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.2 tp -61.76 -24.48 34.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -74.78 -48.98 22.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 168.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.733 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 10.6 ptp -63.84 -44.81 92.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.781 -171.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.782 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.71 -46.01 19.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 1.077 ' HA ' HD12 ' A' ' 991' ' ' LEU . 22.8 tm0? -62.87 -43.77 97.91 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.87 -175.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 54.3 mttp -62.33 -33.9 75.59 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.341 0.591 . . . . 0.0 109.7 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.552 ' HG ' ' CB ' ' A' 1031 ' ' ASP . 3.6 tp -71.49 -38.82 71.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.744 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.077 HD12 ' HA ' ' A' ' 988' ' ' GLN . 5.6 mt -61.79 -51.59 67.66 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.493 0.663 . . . . 0.0 109.451 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.49 -45.12 77.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.065 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.67 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 50.0 m -64.64 -48.44 74.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.168 -177.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.34 -40.13 8.06 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -167.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.053 ' HA ' HD12 ' A' 1028 ' ' LEU . 3.5 tt -60.99 -41.14 95.9 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.723 175.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -61.43 -42.57 98.95 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 993' ' ' SER . 68.4 mm-40 -52.39 -48.35 65.69 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.088 175.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.536 ' O ' HG11 ' A' ' 955' ' ' VAL . 4.0 mm? -58.55 -37.26 75.32 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 110.191 -175.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -58.04 -44.43 87.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.195 -178.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.701 ' O ' ' HB2' ' A' 1004 ' ' LEU . 16.6 m-80 -93.81 -11.17 31.86 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.483 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.485 ' HD3' ' HA ' ' A' 1001 ' ' LYS . 36.1 mmtm -85.97 -40.66 15.61 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.281 -0.168 . . . . 0.0 111.316 -176.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.683 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 42.5 tpp -77.44 -36.5 53.01 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 172.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.82 ' O ' ' HB2' ' A' 1007 ' ' GLN . 63.0 tttp -53.87 -53.4 53.05 Favored 'General case' 0 C--O 1.211 -0.939 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 171.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.701 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.7 tt -53.06 -52.2 59.31 Favored 'General case' 0 C--O 1.22 -0.482 0 O-C-N 123.932 0.77 . . . . 0.0 111.336 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.464 ' O ' ' HD2' ' A' 1017 ' ' TYR . . . -55.76 -52.22 64.7 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.09 0.472 . . . . 0.0 109.939 -178.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.578 HE21 ' HB3' ' A' ' 948' ' ' PRO . 7.4 mm100 -72.74 -9.83 59.09 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.626 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.82 ' HB2' ' O ' ' A' 1003 ' ' LYS . 6.2 tp60 -95.34 -27.44 15.46 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.399 0.619 . . . . 0.0 110.823 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 23.4 t80 -94.04 -2.07 53.5 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.432 ' HA ' ' OE1' ' A' 1014 ' ' GLN . 5.4 p -28.95 115.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 113.73 -1.577 . . . . 0.0 114.285 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.5 ttt -99.25 -82.55 0.44 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.996 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 91.7 m -155.83 -82.07 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 172.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 20.2 m -90.29 -16.95 28.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.46 0.648 . . . . 0.0 109.808 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.641 ' O ' ' HB3' ' A' 1016 ' ' GLU . 17.2 tp -74.0 -5.78 43.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.939 176.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.432 ' OE1' ' HA ' ' A' 1009 ' ' VAL . 8.7 tp60 -57.31 -41.19 79.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.452 0.644 . . . . 0.0 110.429 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' 1019 ' ' LYS . 12.4 pt20 -70.22 -26.6 63.94 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.918 -177.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.641 ' HB3' ' O ' ' A' 1013 ' ' LEU . 2.7 tp10 -53.74 -53.82 46.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.586 0.231 . . . . 0.0 110.875 166.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.464 ' HD2' ' O ' ' A' 1005 ' ' ALA . 0.4 OUTLIER -64.1 -25.16 67.98 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.529 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 28.8 tptp -74.42 -25.29 59.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.389 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' 1015 ' ' GLN . 34.7 mmtp -68.55 -57.67 5.43 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -50.26 -35.08 25.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.323 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.423 ' HE2' ' HB2' ' A' 1025 ' ' ALA . 1.7 tmt? -66.4 -43.58 85.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.765 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 41.3 tp -64.49 -39.25 93.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.756 0.312 . . . . 0.0 110.954 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 41.1 m -63.05 -32.88 74.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.596 0.713 . . . . 0.0 110.335 175.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.513 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.12 -39.77 40.23 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.812 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.423 ' HB2' ' HE2' ' A' 1021 ' ' MET . . . -60.4 -35.18 75.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.78 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 11.2 t-80 -62.97 -39.2 93.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.898 174.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.8 82.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.52 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.053 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.94 -34.28 71.32 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.317 0.579 . . . . 0.0 110.296 179.297 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.631 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.59 -32.78 65.56 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.629 -0.67 . . . . 0.0 110.666 171.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 99.3 t -71.7 -27.99 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.68 175.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.552 ' CB ' ' HG ' ' A' ' 990' ' ' LEU . 2.5 p30 -74.27 -40.92 62.01 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.632 -0.827 . . . . 0.0 109.478 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -60.28 -49.65 76.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.69 ' O ' ' HG ' ' A' 1036 ' ' LEU . 54.1 tptt -59.97 -49.48 77.53 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.787 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' 1038 ' ' VAL . 65.9 t30 -62.76 -43.61 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.378 -176.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 991' ' ' LEU . 19.1 tp -72.82 -38.08 67.29 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.031 -175.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.74 ' HA ' HG21 ' A' ' 929' ' ' VAL . 3.5 pp -61.0 -19.55 61.45 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 120.688 0.28 . . . . 0.0 110.586 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -98.52 -33.96 10.79 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.951 HG22 ' HG2' ' A' ' 983' ' ' GLU . 19.9 t -53.11 -58.9 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.875 172.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.838 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -83.19 -24.32 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.749 -177.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.697 ' H ' HD12 ' A' 1039 ' ' ILE . 8.6 t70 -58.12 -42.21 85.26 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 163.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' 1045 ' ' LYS . 36.5 mt-30 -68.29 -34.73 76.7 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.888 172.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.756 ' HA ' ' HG2' ' A' 1045 ' ' LYS . . . -52.39 -51.61 58.1 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.891 0.377 . . . . 0.0 110.952 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.744 ' HG3' ' HA ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER -47.28 -41.48 18.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.378 172.102 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.697 ' N ' ' HD3' ' A' 1043 ' ' ARG . 28.0 tp -80.37 -26.64 38.51 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.966 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.867 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.0 mmmt -64.32 -39.94 94.92 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.532 ' HB2' HG13 ' A' ' 975' ' ' VAL . 13.7 tmm? -63.2 -43.32 98.48 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.705 176.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.567 ' O ' ' HB2' ' A' 1051 ' ' ARG . 41.8 mm -62.71 -44.17 99.25 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 173.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.6 m -47.83 -45.17 29.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.596 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -86.98 -56.81 3.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.883 0.373 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 19.3 t -94.89 32.07 1.73 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.726 -168.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' 1047 ' ' ILE . 45.8 ttp180 -64.5 124.07 84.85 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -44.44 -64.26 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.618 2.879 . . . . 0.0 113.479 -174.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 61.3 m80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.351 -0.833 . . . . 0.0 109.798 178.497 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 4.9 tpp180 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.4 m -86.37 50.56 2.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.538 ' H ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER 42.3 52.45 4.58 Favored 'General case' 0 CA--C 1.498 -1.051 0 C-N-CA 123.494 0.717 . . . . 0.0 111.728 176.1 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.9 t70 -46.77 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 O-C-N 125.694 1.871 . . . . 0.0 112.742 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.729 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.5 tmtp? -36.4 -21.16 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 124.212 1.005 . . . . 0.0 112.519 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.743 ' HA ' HG23 ' A' ' 968' ' ' THR . 19.2 m -60.49 -53.84 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 C-N-CA 123.284 0.634 . . . . 0.0 112.364 175.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.451 ' N ' HG23 ' A' ' 925' ' ' VAL . 38.5 t80 -79.77 -37.37 35.5 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 122.084 0.945 . . . . 0.0 108.908 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 45.7 mt-10 -58.37 -54.84 42.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.703 -178.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.729 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 65.6 t30 -73.68 -33.01 64.24 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -172.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.644 HG11 ' N ' ' A' 1036 ' ' LEU . 21.3 t -63.06 -32.97 58.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.567 172.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.633 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.8 m -61.31 -35.83 78.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 170.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.87 -31.97 69.27 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.18 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.932 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.5 tt -64.12 -38.4 90.92 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.606 ' HA ' HG12 ' A' ' 936' ' ' VAL . 22.0 t -69.4 -41.49 80.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.933 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -58.67 -35.29 72.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.177 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.38 -24.78 42.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.788 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.606 HG12 ' HA ' ' A' ' 933' ' ' VAL . 9.1 p -83.12 -15.39 11.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.406 171.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -68.94 -37.72 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 165.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.743 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.0 mm-40 -52.48 -36.88 55.95 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.744 169.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.3 tmm? -60.99 -41.92 97.4 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.579 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 50.2 m -73.82 -31.26 63.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.735 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 938' ' ' GLU . 22.9 p -77.05 -43.35 34.79 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.691 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.3 mmtp -52.76 -53.24 50.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.187 174.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.854 HG13 ' HE1' ' A' ' 951' ' ' TYR . 14.2 tt -63.58 -23.62 33.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.8 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 27.2 mt-30 -55.39 -62.79 3.84 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.319 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.8 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 44.4 Cg_endo -97.31 25.47 0.24 Allowed 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 121.631 1.554 . . . . 0.0 114.028 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.887 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -113.58 138.8 22.73 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.66 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 69.0 Cg_endo -88.38 -174.07 1.03 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 123.611 2.874 . . . . 0.0 109.972 165.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.783 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 8.1 Cg_endo -51.87 -31.92 44.84 Favored 'Trans proline' 0 C--O 1.247 0.935 0 C-N-CA 122.4 2.067 . . . . 0.0 112.361 176.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.42 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 48.1 mt-10 -52.75 -38.56 61.12 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.775 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.887 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 44.2 mt-10 -104.49 6.42 34.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.854 ' HE1' HG13 ' A' ' 943' ' ' ILE . 5.4 m-30 -66.5 -38.3 86.93 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 170.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.112 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -75.87 -47.72 3.79 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.211 174.17 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.112 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.2 Cg_exo -55.28 -26.5 52.5 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.719 1.612 . . . . 0.0 114.943 172.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.644 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 16.8 ptp -73.37 -36.01 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.596 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.972 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -64.08 -27.47 42.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.424 169.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 20.7 ttmm -58.49 -38.45 77.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 175.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.429 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 4.9 mm-40 -57.87 -48.18 80.58 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.271 178.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 936' ' ' VAL . 6.1 m -73.3 -22.61 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 O-C-N 122.205 -0.31 . . . . 0.0 111.198 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.473 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.29 -44.42 34.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.224 -0.989 . . . . 0.0 111.459 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.28 -26.83 68.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.389 171.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.932 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.28 -54.4 37.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 174.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 965' ' ' LEU . 3.4 tm? -62.09 -37.15 83.97 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 959' ' ' GLY . 34.1 mmt180 -56.25 -60.22 3.81 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 172.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 2.1 p -52.79 -40.76 63.5 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.194 0.521 . . . . 0.0 110.211 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 962' ' ' LEU . 2.7 tm? -57.05 -35.29 69.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.026 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.45 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 48.6 tp -64.64 -29.04 70.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -178.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.58 96.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.178 0.513 . . . . 0.0 110.097 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.743 HG23 ' HA ' ' A' ' 925' ' ' VAL . 4.5 m -64.24 -35.97 82.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.628 173.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.737 HG13 HD11 ' A' ' 984' ' ' ILE . 83.1 t -54.95 -31.09 24.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.726 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.534 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -74.87 -28.3 60.6 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 120.528 0.204 . . . . 0.0 111.485 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 23.8 mm-40 -64.79 -53.99 38.25 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 123.027 1.394 . . . . 0.0 108.543 172.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.478 ' HB3' HG23 ' A' 1039 ' ' ILE . 10.4 p -67.24 -22.15 65.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.888 -1.505 . . . . 0.0 111.301 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.708 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 44.6 tp -54.34 -54.67 45.49 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-O 118.938 -0.553 . . . . 0.0 112.127 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 31.3 Cg_exo -62.39 -25.39 76.22 Favored 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 121.3 1.333 . . . . 0.0 110.941 171.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 980' ' ' THR . 49.4 t -73.6 -12.88 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.567 174.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.779 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 4.9 tt -74.46 -53.96 3.29 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.557 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.3 Cg_exo -62.36 -22.26 73.84 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.111 1.207 . . . . 0.0 110.693 173.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.543 ' HA ' ' HG3' ' A' 1049 ' ' GLN . . . -70.35 -65.13 0.77 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.101 173.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.1 m -161.38 -32.76 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.788 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -172.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.656 HG22 ' HA ' ' A' ' 976' ' ' LEU . 1.4 t -66.27 -13.82 61.02 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -173.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.779 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 42.4 t60 -49.83 -21.82 1.26 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.879 0.471 . . . . 0.0 112.097 -174.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.562 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 6.1 ptp180 -78.68 -53.43 7.16 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.024 0.44 . . . . 0.0 110.634 176.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.812 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.2 OUTLIER -77.48 -46.27 23.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -175.419 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.737 HD11 HG13 ' A' ' 969' ' ' VAL . 11.8 tt -55.45 -34.56 34.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.119 0.485 . . . . 0.0 110.112 -174.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -72.94 -34.26 66.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.305 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.624 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 23.1 ptm -66.22 -58.04 6.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.332 -0.547 . . . . 0.0 112.006 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.603 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.42 -36.29 33.91 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 6.5 tp60 -67.15 -36.25 81.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.774 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -66.86 -31.41 71.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.596 0.712 . . . . 0.0 109.123 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.425 HD11 ' CG ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -71.45 -39.44 70.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.628 178.315 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.797 ' HA ' ' OD1' ' A' ' 994' ' ' ASP . 47.3 mt -74.03 -29.12 61.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.299 -176.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -60.95 -43.62 98.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 15.5 m -77.65 -33.85 53.34 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.804 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.797 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p-10 -91.37 -38.07 12.83 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.853 -0.529 . . . . 0.0 111.247 -170.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.518 ' HA ' ' CD1' ' A' 1028 ' ' LEU . 2.7 tm? -59.01 -37.13 76.2 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.586 ' O ' HG22 ' A' ' 999' ' ' ILE . . . -59.93 -51.85 67.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.224 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' 1001 ' ' LYS . 2.8 pt-20 -63.7 -35.23 79.88 Favored 'General case' 0 C--O 1.215 -0.731 0 C-N-CA 118.688 -1.205 . . . . 0.0 110.105 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.557 HD11 ' CA ' ' A' 1025 ' ' ALA . 1.8 mm? -69.43 -42.34 75.14 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.689 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.808 ' HA ' HG11 ' A' ' 955' ' ' VAL . 17.4 tt -59.65 -25.36 31.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.009 0.433 . . . . 0.0 110.804 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.691 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.0 OUTLIER -104.03 -7.71 20.1 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.987 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 31.0 mmtp -83.48 -37.69 22.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.972 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 18.9 mmt -72.91 -41.97 64.04 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.735 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.8 ttpt -58.13 -48.71 79.38 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 114.275 -1.33 . . . . 0.0 109.639 172.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1000 ' ' ASN . 45.7 tp -58.5 -45.74 88.14 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.7 ' HB1' HE22 ' A' 1014 ' ' GLN . . . -63.77 -49.3 73.5 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.372 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.2 pp0? -67.24 -17.64 64.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.901 176.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.735 ' HB2' ' O ' ' A' 1003 ' ' LYS . 33.9 tp60 -77.77 -33.64 52.65 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.6 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.564 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 17.4 t80 -74.04 -76.87 0.12 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.393 -179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.481 HG23 HD13 ' A' 1013 ' ' LEU . 7.5 p 32.33 77.08 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 124.321 1.013 . . . . 0.0 112.438 -177.199 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' 1008 ' ' TYR . 68.2 mtt -139.6 -103.71 0.16 Allowed 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.804 -178.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 13.1 m -84.21 132.09 34.69 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 23.9 p 42.42 59.69 2.61 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -162.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.481 HD13 HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -44.78 -58.09 3.31 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.676 -149.714 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.75 ' HG3' ' HE2' ' A' ' 951' ' ' TYR . 0.6 OUTLIER -88.46 -42.93 11.81 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.557 ' O ' ' HG3' ' A' 1019 ' ' LYS . 45.0 mt-30 -59.8 -48.28 82.3 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -156.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -50.88 -52.13 44.83 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 111.309 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.58 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.7 m-30 -72.09 -24.72 61.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.849 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.673 ' HA ' ' HB3' ' A' 1021 ' ' MET . 24.3 tttt -67.92 -31.28 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.655 0.264 . . . . 0.0 110.52 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' 1015 ' ' GLN . 84.1 mttt -61.45 -57.67 11.28 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.433 ' H ' ' HG3' ' A' 1020 ' ' GLN . 54.2 mt-30 -50.58 -45.44 57.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.999 172.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.673 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 6.4 ttt -56.41 -54.05 50.14 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.527 0.731 . . . . 0.0 112.0 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.93 -45.22 90.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.644 -175.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 17.0 m -61.22 -32.42 72.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.332 0.587 . . . . 0.0 110.612 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.498 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.23 -43.56 28.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.98 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.557 ' CA ' HD11 ' A' ' 998' ' ' LEU . . . -59.1 -31.48 68.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.927 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -70.0 -38.44 75.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.435 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -59.95 -44.11 94.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 174.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.717 ' HA ' ' OD2' ' A' ' 994' ' ' ASP . 1.9 tt -61.76 -54.86 36.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.58 0.705 . . . . 0.0 110.427 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.603 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -56.49 -36.83 69.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.949 -176.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1030 ' ' VAL . . . . . . . . . . . . . 70.4 t -75.2 -41.68 44.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.808 0.337 . . . . 0.0 110.602 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.471 ' O ' HD21 ' A' ' 991' ' ' LEU . 43.6 m-20 -67.05 -30.0 69.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -52.23 -50.91 61.05 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 164.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' 1036 ' ' LEU . 58.1 mtmt -64.22 -17.41 63.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.596 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' 1038 ' ' VAL . 59.5 t30 -75.38 -37.3 60.65 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.013 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 991' ' ' LEU . 33.3 tp -75.27 -20.44 59.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.644 ' N ' HG11 ' A' ' 929' ' ' VAL . 45.9 tp -57.75 -51.09 71.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.28 174.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -31.46 67.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.728 178.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.812 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 18.6 t -60.69 -62.45 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.005 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.696 HG22 ' HB ' ' A' ' 925' ' ' VAL . 1.8 mt -77.6 -24.8 14.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.343 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.546 ' O ' ' HB3' ' A' 1043 ' ' ARG . 18.0 t70 -61.81 -37.88 86.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.798 165.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.71 ' O ' ' HG2' ' A' 1045 ' ' LYS . 13.3 mm100 -70.74 -32.33 69.46 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.076 171.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.531 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.81 -45.3 74.36 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 121.353 0.597 . . . . 0.0 110.081 171.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.58 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.09 -50.19 15.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.127 170.938 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.509 ' N ' ' HD3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -79.64 -20.88 45.68 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.374 -0.204 . . . . 0.0 111.416 178.657 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.783 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 38.0 mmtm -65.22 -40.4 94.03 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.67 -44.45 96.45 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.946 -1.024 . . . . 0.0 109.412 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.427 ' HB ' HD23 ' A' 1044 ' ' LEU . 43.8 mm -64.59 -48.22 85.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.442 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -35.28 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.125 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.543 ' HG3' ' HA ' ' A' ' 978' ' ' ALA . 1.1 tm0? -79.19 -50.1 11.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 20.1 m -64.78 -47.06 79.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.118 -177.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -173.39 98.24 0.33 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.46 -71.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.189 1.926 . . . . 0.0 112.366 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 42.9 m80 . . . . . 0 C--O 1.245 0.866 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.046 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.847 ' HE ' ' HA ' ' A' ' 920' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.734 0.302 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -82.49 47.48 1.17 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.564 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.453 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 46.84 72.03 0.27 Allowed 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.951 0.9 . . . . 0.0 113.035 174.53 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.941 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 1.9 t70 -45.44 -175.5 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 O-C-N 125.624 1.828 . . . . 0.0 112.873 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.529 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.1 tmtp? -42.56 -22.66 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.388 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.858 ' HA ' HG23 ' A' ' 968' ' ' THR . 15.5 m -56.64 -51.61 63.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.27 174.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.436 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 5.0 t80 -77.61 -34.43 53.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.179 -1.008 . . . . 0.0 109.348 -175.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -61.68 -49.25 77.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.418 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.437 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.5 -38.21 77.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.539 -176.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 1.073 ' HA ' HD13 ' A' ' 932' ' ' LEU . 2.9 t -66.0 -29.67 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.846 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 38.6 m -61.67 -40.28 94.41 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.08 -27.63 60.16 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 114.568 -1.197 . . . . 0.0 113.351 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 1.101 HD11 ' HB2' ' A' ' 965' ' ' LEU . 10.0 mp -64.13 -41.88 97.05 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 117.86 0.83 . . . . 0.0 109.745 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.592 ' O ' HG23 ' A' ' 937' ' ' ILE . 77.9 t -70.59 -35.38 61.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.307 0.575 . . . . 0.0 109.909 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.2 mmpt? -67.12 -19.14 65.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.168 0.509 . . . . 0.0 109.971 174.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -83.0 -26.54 31.14 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.653 175.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.569 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.5 p -88.13 -15.09 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 120.131 -0.627 . . . . 0.0 110.274 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.592 HG23 ' O ' ' A' ' 933' ' ' VAL . 21.0 pt -75.38 -31.84 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 167.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.9 mm-40 -56.22 -44.84 79.92 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.873 166.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.758 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 26.1 ttt -59.16 -38.98 81.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.726 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.553 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.6 m -67.82 -40.94 83.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.826 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.569 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.4 t -76.05 -41.46 50.62 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -175.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.625 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 10.1 mmtm -47.31 -54.03 12.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.876 176.168 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.629 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 13.6 tt -71.23 -21.51 21.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.548 -174.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.796 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 14.2 mm100 -54.74 -63.02 3.24 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.796 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 93.4 Cg_endo -98.69 -5.64 0.75 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.699 1.599 . . . . 0.0 114.178 -176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -111.7 151.63 43.53 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.502 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 90.3 Cg_endo -78.79 -176.61 3.37 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.563 2.842 . . . . 0.0 112.796 -176.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.732 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 75.3 Cg_exo -51.98 -25.75 23.03 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 123.133 2.555 . . . . 0.0 113.35 175.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.411 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 30.1 mm-40 -56.82 -30.7 63.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.829 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.682 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.9 mp0 -97.63 -1.05 44.56 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.641 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.732 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -57.48 -40.69 79.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 170.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.045 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -74.98 -52.45 3.26 Favored Pre-proline 0 CA--C 1.554 1.133 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.115 177.112 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.045 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.72 -32.33 45.03 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.089 1.859 . . . . 0.0 115.031 172.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.758 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 27.3 ptt? -68.53 -44.54 74.38 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.921 -0.711 . . . . 0.0 110.227 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.683 ' HB ' ' HB3' ' A' 1002 ' ' MET . 70.2 t -66.23 -26.46 38.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.032 170.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 1.6 tmtp? -59.67 -36.99 77.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.2 mm-40 -55.96 -47.35 77.79 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.707 175.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 3.2 m -73.89 -22.06 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 120.762 0.315 . . . . 0.0 111.241 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.68 -43.47 59.87 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.022 175.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.1 tp -60.29 -23.14 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.345 -0.427 . . . . 0.0 110.512 171.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.856 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.99 -56.36 15.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.776 177.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 991' ' ' LEU . 13.9 tp -62.59 -38.67 91.06 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.987 176.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 20.4 tpp180 -51.4 -62.64 1.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 0.0 111.68 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 20.5 p -56.2 -36.82 68.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.841 0.353 . . . . 0.0 110.927 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 1.101 ' HB2' HD11 ' A' ' 932' ' ' LEU . 31.0 tp -58.08 -34.0 69.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.083 176.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 1.142 ' HA ' HG22 ' A' ' 969' ' ' VAL . 4.1 tt -70.32 -24.08 62.95 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.726 -0.389 . . . . 0.0 111.154 -177.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.96 95.87 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 167.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.858 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -69.36 -42.04 75.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.077 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 1.142 HG22 ' HA ' ' A' ' 966' ' ' LEU . 32.9 m -62.44 -26.34 40.19 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.561 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 18.5 t70 -73.25 -22.9 60.3 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.541 173.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.6 mm-40 -74.49 -49.94 20.2 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-O 122.113 0.959 . . . . 0.0 109.296 169.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.628 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 93.6 p -63.9 -26.46 68.61 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.929 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 1.061 ' HA ' HD13 ' A' ' 976' ' ' LEU . 0.9 OUTLIER -59.44 -52.26 75.49 Favored Pre-proline 0 N--CA 1.472 0.647 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.383 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.646 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 52.6 Cg_exo -57.2 -26.02 67.53 Favored 'Trans proline' 0 C--N 1.354 0.859 0 CA-C-N 120.687 1.281 . . . . 0.0 110.392 170.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' 1046 ' ' MET . 1.8 t -78.79 -18.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.416 175.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 1.061 HD13 ' HA ' ' A' ' 973' ' ' LEU . 8.5 mp -52.66 -58.42 11.99 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 118.147 0.43 . . . . 0.0 110.265 172.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.63 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 64.4 Cg_exo -54.81 -38.33 92.11 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 121.839 1.693 . . . . 0.0 111.962 174.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.74 -50.18 74.08 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.111 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.598 ' CB ' ' HG3' ' A' 1045 ' ' LYS . 31.1 t 179.63 -26.43 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.871 0.367 . . . . 0.0 111.287 -179.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.64 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 89.9 m -51.56 -21.0 2.2 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -177.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -52.86 -20.13 3.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.675 0.274 . . . . 0.0 111.358 -177.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -76.83 -51.66 10.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.949 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.971 ' HB2' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -65.7 -54.86 21.62 Favored 'General case' 0 CA--C 1.494 -1.205 0 CA-C-O 122.063 0.935 . . . . 0.0 112.142 178.859 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.947 HG21 ' HG ' ' A' ' 976' ' ' LEU . 9.2 tp -63.73 -34.15 66.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 113.713 -1.585 . . . . 0.0 110.097 -164.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -60.1 -45.39 93.13 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.966 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.55 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 24.5 ptm -73.61 -52.94 11.69 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.201 -175.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.621 ' HB3' HD23 ' A' 1035 ' ' LEU . . . -78.65 -44.94 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -172.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.705 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 6.3 tp60 -63.44 -44.09 95.54 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.068 -0.253 . . . . 0.0 111.148 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -67.46 -31.92 72.41 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.482 0.658 . . . . 0.0 109.655 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 986' ' ' MET . 0.3 OUTLIER -64.52 -50.86 65.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.465 175.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 962' ' ' LEU . 3.5 pp -74.2 -27.35 60.76 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.609 -175.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.545 ' N ' HD12 ' A' ' 991' ' ' LEU . 54.6 t30 -58.17 -42.1 85.29 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.458 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 13.5 m -77.82 -28.36 50.23 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.947 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.26 -43.18 8.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -172.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.01 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.88 -44.46 70.47 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 169.336 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -53.86 -45.76 71.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.258 177.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.701 ' O ' ' HG2' ' A' 1001 ' ' LYS . 22.1 mm-40 -61.36 -34.79 75.88 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 121.676 -0.64 . . . . 0.0 111.675 178.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.677 ' HG ' HD13 ' A' 1028 ' ' LEU . 2.4 mm? -69.31 -34.76 75.16 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.02 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 996' ' ' ALA . 19.9 pt -73.68 -13.36 15.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.938 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.657 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 4.8 p30 -104.15 -3.77 23.99 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.701 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 42.2 mmtm -85.71 -30.61 23.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 170.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.005 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 25.0 ptt? -72.92 -38.1 66.97 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 171.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.785 ' O ' ' HB2' ' A' 1007 ' ' GLN . 17.7 tppt? -63.02 -53.87 47.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.923 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.586 HD12 ' HD3' ' A' 1001 ' ' LYS . 17.1 mt -56.13 -46.81 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.495 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.44 -46.97 88.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.626 0.727 . . . . 0.0 110.373 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.436 ' NE2' HG11 ' A' ' 952' ' ' VAL . 0.3 OUTLIER -75.92 -10.36 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.627 0.727 . . . . 0.0 110.03 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.785 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.3 tp60 -88.74 -27.14 21.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.418 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.65 19.62 12.52 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.58 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.59 ' HA ' ' HG2' ' A' 1014 ' ' GLN . 4.2 p -46.17 97.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.795 -1.093 . . . . 0.0 112.693 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.652 ' O ' ' HB2' ' A' 1014 ' ' GLN . 11.2 tpt -146.15 134.36 21.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.108 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 27.0 p -42.46 -48.51 5.23 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.0 m -112.22 -24.34 9.89 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.722 -0.391 . . . . 0.0 112.052 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.407 ' HA ' HD13 ' A' 1013 ' ' LEU . 3.9 mm? -82.4 -22.4 35.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' 1010 ' ' MET . 0.0 OUTLIER -54.62 -32.13 58.37 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.895 0.379 . . . . 0.0 110.979 -176.379 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.657 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 28.8 pt20 -54.86 -35.26 63.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.064 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.414 ' HA ' ' HE2' ' A' 1019 ' ' LYS . 37.7 tt0 -51.39 -52.56 44.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.826 0.346 . . . . 0.0 111.311 172.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.52 ' CE2' HD22 ' A' 1004 ' ' LEU . 3.2 m-85 -74.99 -21.24 59.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.976 0.417 . . . . 0.0 110.67 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.657 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 81.5 tttt -66.79 -47.0 73.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.452 176.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.414 ' HE2' ' HA ' ' A' 1016 ' ' GLU . 65.6 pttt -73.65 -19.53 60.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.047 0.451 . . . . 0.0 110.719 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -80.31 -33.3 37.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.546 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 43.5 ttp -71.66 -39.89 70.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.27 174.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.84 -48.86 72.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.151 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -62.17 -33.29 74.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.406 0.622 . . . . 0.0 110.65 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -76.07 -36.2 59.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.884 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.546 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -61.48 -36.5 80.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.493 178.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' 1030 ' ' VAL . 60.2 t60 -63.3 -35.83 81.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.885 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.59 68.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.335 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.01 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.61 -30.66 67.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.281 0.563 . . . . 0.0 110.276 178.003 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.503 ' N ' HD23 ' A' 1028 ' ' LEU . . . -55.84 -40.23 72.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 170.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' 1026 ' ' HIS . 75.1 t -66.95 -33.47 63.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.035 175.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.568 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.2 p30 -70.73 -41.95 71.2 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.295 -177.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.8 66.84 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 171.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 60.1 tttp -59.52 -39.84 85.18 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.748 ' O ' HG23 ' A' 1038 ' ' VAL . 20.9 t-20 -68.43 -49.11 62.31 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 121.05 0.453 . . . . 0.0 110.282 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 987' ' ' ALA . 3.3 tm? -67.54 -36.36 80.84 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.427 ' N ' HG11 ' A' ' 929' ' ' VAL . 5.2 tt -49.19 -44.11 42.79 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.321 0.649 . . . . 0.0 111.812 175.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' 1040 ' ' ASP . 24.3 t70 -89.0 -41.57 12.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.85 -176.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.971 HG12 ' HB2' ' A' ' 983' ' ' GLU . 3.3 t -74.26 -29.42 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' OE1' ' A' ' 983' ' ' GLU . 1.5 tt -81.14 -31.32 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.401 0.68 . . . . 0.0 110.302 170.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.486 ' HB3' ' O ' ' A' 1037 ' ' ASP . 35.3 t0 -52.78 -38.9 61.75 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 161.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' 1038 ' ' VAL . 49.8 mt-30 -76.27 -25.38 54.87 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.887 174.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.739 ' HB2' ' OE1' ' A' ' 983' ' ' GLU . . . -52.42 -56.31 15.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.709 1.141 . . . . 0.0 110.428 168.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.941 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 2.7 tpt180 -60.66 -29.77 69.48 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.464 178.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.5 tp -78.46 -25.36 45.84 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.37 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.598 ' HG3' ' CB ' ' A' ' 979' ' ' SER . 3.4 mptp? -62.23 -35.98 80.59 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.886 0.875 . . . . 0.0 109.504 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.77 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.7 tmt? -69.48 -42.31 74.98 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.223 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.483 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.9 mm -60.62 -31.75 49.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.719 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.8 m -64.79 -28.59 69.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.119 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -82.71 -31.48 28.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.947 0.403 . . . . 0.0 110.469 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.5 t -82.81 -17.88 42.47 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.84 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.654 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 66.7 ttt180 -56.45 -55.95 37.09 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.608 -175.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 1.3 Cg_endo -83.46 14.81 2.27 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.275 1.983 . . . . 0.0 113.509 -176.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 79.8 t60 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.568 -177.791 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.814 ' HD2' ' HB2' ' A' 1044 ' ' LEU . 15.0 ttt180 . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 121.089 0.471 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 3.0 t -111.31 29.27 7.96 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.447 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 48.27 59.45 4.28 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.738 -175.422 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.0 t70 -47.33 -173.54 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 O-C-N 125.631 1.832 . . . . 0.0 112.363 -176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.52 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.3 tmtp? -37.78 -25.05 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.374 1.07 . . . . 0.0 112.067 -177.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.722 ' HB ' HG13 ' A' 1039 ' ' ILE . 10.3 m -59.9 -49.79 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.059 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 62.2 t80 -75.93 -40.3 54.42 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.208 -178.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.96 -47.88 84.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.225 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.4 t-20 -72.18 -42.93 65.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.786 -173.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.66 ' CG2' HD11 ' A' 1039 ' ' ILE . 47.1 t -65.02 -30.17 49.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.676 178.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 51.8 m -60.85 -32.53 71.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.87 74.18 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.323 -1.308 . . . . 0.0 113.264 173.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.882 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.1 tt -61.78 -44.05 97.63 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 118.42 1.11 . . . . 0.0 108.314 175.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 937' ' ' ILE . 43.4 t -55.79 -44.1 76.26 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.1 mmpt? -61.58 -38.21 86.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.82 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.55 -25.58 38.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.893 -177.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.674 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.1 p -80.28 -15.58 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 C-N-CA 119.726 -0.789 . . . . 0.0 109.057 170.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 933' ' ' VAL . 20.5 mm -71.46 -35.37 56.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 166.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.633 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 70.4 mm-40 -52.85 -42.4 65.18 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.824 169.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.565 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 35.7 ttp -57.65 -46.69 83.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.485 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.582 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.4 p -72.75 -26.75 61.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.914 0.388 . . . . 0.0 110.979 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.457 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.2 m -78.82 -43.34 25.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.67 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.7 mmtp -54.58 -49.66 69.86 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.209 -1.814 . . . . 0.0 111.193 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.846 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.6 tt -65.57 -28.69 44.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 123.137 0.273 . . . . 0.0 111.599 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.793 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 26.4 mt-30 -50.06 -61.11 4.02 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 64.1 Cg_endo -97.78 16.73 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.562 1.508 . . . . 0.0 113.821 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.83 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -100.86 148.58 35.24 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -173.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 79.6 Cg_endo -86.4 -178.68 2.82 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.433 2.755 . . . . 0.0 110.231 165.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.864 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 10.0 Cg_endo -51.62 -34.63 53.78 Favored 'Trans proline' 0 C--O 1.249 1.057 0 C-N-CA 122.648 2.232 . . . . 0.0 112.73 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.534 ' O ' ' HD2' ' A' ' 953' ' ' PRO . 25.0 mt-10 -54.0 -39.05 65.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.018 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.83 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -95.83 2.42 53.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.864 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 21.0 m-30 -65.7 -38.56 89.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 172.22 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.983 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.34 -55.47 6.05 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 119.536 -0.866 . . . . 0.0 111.511 174.117 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.983 ' HD3' HG13 ' A' ' 952' ' ' VAL . 75.2 Cg_exo -51.02 -32.07 37.29 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 122.124 1.883 . . . . 0.0 115.166 173.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.846 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.9 ptt? -65.93 -45.18 82.8 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 121.502 -0.749 . . . . 0.0 110.157 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.698 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.8 t -69.94 -25.52 28.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.202 0.525 . . . . 0.0 110.022 173.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 61.0 tttm -61.2 -37.93 84.75 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.7 mm-40 -54.23 -44.61 71.87 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.494 172.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.7 t -65.57 -28.64 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.497 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.596 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.72 -43.45 51.32 Favored Glycine 0 C--N 1.328 0.131 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.561 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.4 mm? -62.74 -32.28 73.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 172.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.882 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -54.3 -56.13 21.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.012 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.785 HD11 HD13 ' A' ' 991' ' ' LEU . 61.1 tp -66.53 -36.47 82.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -58.11 -49.68 76.11 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.741 -0.599 . . . . 0.0 110.71 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 26.8 m -53.69 -35.78 61.47 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.124 173.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.717 HD11 ' HB2' ' A' ' 932' ' ' LEU . 7.2 mt -66.02 -38.03 87.41 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 120.847 0.356 . . . . 0.0 110.134 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.17 -32.65 37.04 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.203 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.41 -47.63 63.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.462 HG22 ' O ' ' A' ' 965' ' ' LEU . 6.8 t -69.56 -32.35 71.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.314 0.578 . . . . 0.0 110.109 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.923 HG13 HD11 ' A' ' 984' ' ' ILE . 45.5 t -55.5 -32.5 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.126 169.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.736 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 27.6 t70 -71.08 -25.38 62.6 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 120.636 0.255 . . . . 0.0 110.875 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 975' ' ' VAL . 5.4 mm-40 -65.52 -49.69 68.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.984 1.373 . . . . 0.0 108.408 169.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.587 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.2 t -65.87 -24.28 66.83 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 113.834 -1.53 . . . . 0.0 111.766 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.708 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.2 OUTLIER -61.58 -53.21 63.61 Favored Pre-proline 0 C--O 1.215 -0.761 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.791 -176.496 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 6.9 Cg_endo -54.77 -28.44 57.48 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 121.497 1.57 . . . . 0.0 111.584 168.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.71 -11.59 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.881 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.914 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -67.58 -51.97 29.2 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-O 118.965 -0.541 . . . . 0.0 111.316 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.578 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 32.5 Cg_exo -60.83 -33.01 93.37 Favored 'Trans proline' 0 C--N 1.363 1.297 0 C-N-CA 121.503 1.468 . . . . 0.0 110.715 173.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -60.13 -54.89 40.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.873 175.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.864 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -168.74 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.78 HG22 ' HB ' ' A' ' 984' ' ' ILE . 17.4 m -52.46 -20.2 2.72 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -170.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.914 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 19.1 p-80 -49.66 -22.19 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -171.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.24 -54.78 11.3 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.299 178.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.885 ' HB3' HG22 ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.14 -41.82 40.3 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 179.372 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.923 HD11 HG13 ' A' ' 969' ' ' VAL . 10.8 tp -60.87 -30.6 47.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.395 -171.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.87 -42.82 60.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.173 174.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.596 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 18.1 ptp -64.34 -52.83 56.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -173.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.839 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -75.94 -35.57 59.66 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.61 -174.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.573 ' NE2' HG13 ' A' ' 984' ' ' ILE . 32.9 mt-30 -57.97 -54.98 40.83 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.815 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -57.89 -36.6 72.64 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.802 0.81 . . . . 0.0 109.454 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.616 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 14.0 tp -60.63 -62.06 2.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.963 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.995 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 1.3 pp -73.1 -23.23 60.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -172.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.501 ' N ' HD12 ' A' ' 991' ' ' LEU . 24.2 t-20 -64.69 -35.66 81.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 23.7 m -76.04 -36.83 58.93 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.886 -178.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.05 -32.77 13.66 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.323 -171.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.025 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.7 tm? -58.46 -38.0 76.62 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.469 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -67.72 -41.17 83.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.482 ' HA ' ' OD1' ' A' 1000 ' ' ASN . 6.9 mm-40 -53.61 -44.3 69.34 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.3 172.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.572 ' HB3' ' CG1' ' A' ' 955' ' ' VAL . 4.2 mm? -69.56 -29.31 66.84 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.981 178.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.722 ' O ' ' HG2' ' A' 1002 ' ' MET . 43.8 mt -61.14 -45.5 98.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 174.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.586 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.3 OUTLIER -82.91 -15.26 52.1 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.985 -0.447 . . . . 0.0 111.292 178.472 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.62 ' HA ' ' CB ' ' A' 1004 ' ' LEU . 66.1 mttm -86.37 -26.58 24.74 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.478 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.869 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 21.1 ptt? -73.93 -34.24 64.26 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.922 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.6 ttpt -73.91 -18.03 60.96 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 113.324 -1.762 . . . . 0.0 109.573 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.62 ' CB ' ' HA ' ' A' 1001 ' ' LYS . 35.9 tp -85.84 -54.72 4.34 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.178 0.924 . . . . 0.0 110.646 -173.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.22 -38.62 83.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.263 0.554 . . . . 0.0 109.848 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -23.92 54.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.059 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.922 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.9 tp-100 -69.89 -42.16 73.79 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.355 0.598 . . . . 0.0 109.75 177.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.3 OUTLIER -70.4 -62.92 1.2 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.483 177.213 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.419 ' O ' HG22 ' A' 1009 ' ' VAL . 8.5 p 40.77 34.14 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 124.714 1.259 . . . . 0.0 112.541 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.514 ' CE ' ' HA ' ' A' 1010 ' ' MET . 1.5 tpt -93.74 98.87 11.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 172.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 7.0 t -32.75 -49.26 0.22 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.9 m -79.57 -43.91 22.09 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.735 -176.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 3.6 mm? -85.36 -7.65 58.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 111.394 -175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? -60.23 -33.15 71.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.227 -176.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.5 -37.06 74.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.561 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -50.09 -39.84 43.74 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.775 0.321 . . . . 0.0 111.673 173.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 5.6 m-30 -84.89 -24.0 28.68 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.831 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.494 ' HB2' HE22 ' A' 1014 ' ' GLN . 76.1 tttt -69.74 -44.47 70.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.826 0.346 . . . . 0.0 110.401 174.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -57.95 -57.47 12.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.475 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -57.04 -37.21 71.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.71 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.474 ' HE2' ' HA ' ' A' 1018 ' ' LYS . 40.5 ttp -64.73 -42.15 95.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.802 0.335 . . . . 0.0 110.934 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.1 tp -66.06 -41.7 90.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.943 0.402 . . . . 0.0 110.72 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 4.5 m -65.42 -30.08 70.85 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.856 0.836 . . . . 0.0 109.99 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.442 ' C ' HD21 ' A' ' 998' ' ' LEU . . . -78.91 -40.08 33.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.695 -1.138 . . . . 0.0 109.91 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.518 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.63 ' O ' HG23 ' A' 1030 ' ' VAL . 15.2 t-80 -65.13 -38.22 89.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.81 -46.79 74.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.209 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.025 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.87 -32.58 73.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 109.988 179.566 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.626 ' N ' HD23 ' A' 1028 ' ' LEU . . . -60.52 -33.96 73.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.475 170.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' 1026 ' ' HIS . 85.9 t -75.82 -32.45 23.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 109.828 177.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.995 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 7.5 m-20 -59.34 -44.43 92.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.237 172.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.591 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -58.2 -52.97 63.34 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.793 170.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 1.6 tmtp? -53.47 -38.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.276 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.611 ' O ' HG23 ' A' 1038 ' ' VAL . 66.5 t30 -71.88 -39.89 69.31 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.911 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.793 HD22 HD21 ' A' ' 991' ' ' LEU . 17.1 tp -74.23 -29.52 61.74 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 121.279 -0.168 . . . . 0.0 110.657 -176.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.641 ' HB3' ' CG1' ' A' ' 929' ' ' VAL . 4.7 pp -70.5 -26.66 63.7 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.35 -39.68 38.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 174.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.885 HG22 ' HB3' ' A' ' 983' ' ' GLU . 19.5 t -51.77 -56.15 6.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.163 174.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.722 HG13 ' HB ' ' A' ' 925' ' ' VAL . 20.5 pt -94.24 -26.48 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -170.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.632 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 2.8 t0 -55.25 -42.63 73.72 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.511 162.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.673 ' O ' ' HG2' ' A' 1045 ' ' LYS . 21.8 mt-30 -77.61 -22.67 50.45 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.676 175.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.52 -50.79 64.69 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.055 0.455 . . . . 0.0 110.463 169.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.688 ' HG2' HG21 ' A' ' 925' ' ' VAL . 16.8 mmt180 -54.73 -38.12 66.74 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.093 0.473 . . . . 0.0 110.434 172.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.814 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 56.9 tp -69.48 -28.39 66.04 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.286 174.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.864 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 24.5 mmtp -67.84 -40.9 83.66 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.861 0.839 . . . . 0.0 109.133 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 26.6 ttt -59.23 -46.44 88.47 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.161 -1.381 . . . . 0.0 108.889 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.9 -50.8 78.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.011 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.1 m -41.84 -47.96 4.28 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -96.71 -36.55 10.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 6.4 m -86.44 -30.85 21.74 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -173.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -146.89 74.6 12.12 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.07 137.75 81.36 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 123.006 2.47 . . . . 0.0 112.729 -173.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 33.6 t60 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.852 -0.594 . . . . 0.0 109.888 179.284 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.72 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 8.4 tpt180 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.408 ' HB3' ' O ' ' A' ' 920' ' ' ARG . 22.7 t 76.88 26.96 0.75 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.393 0.616 . . . . 0.0 110.054 -173.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 46.93 69.79 0.46 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.706 168.635 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.5 t70 -47.05 -174.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.648 -1.615 . . . . 0.0 112.67 -178.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.402 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 1.2 tmtp? -40.12 -23.05 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.998 0.919 . . . . 0.0 112.169 -177.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.672 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 7.5 m -56.36 -50.28 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 172.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.506 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 7.6 t80 -75.08 -29.75 60.76 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.011 0.91 . . . . 0.0 108.8 -176.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.37 -56.22 9.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.615 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.423 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.81 -38.75 76.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.677 -175.636 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.936 ' HB ' HD11 ' A' 1039 ' ' ILE . 9.5 p -60.41 -34.13 56.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.904 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 93.4 m -69.1 -35.66 76.71 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.47 -28.03 61.7 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.618 174.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.916 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.1 tt -66.83 -46.8 73.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 937' ' ' ILE . 17.7 t -59.59 -39.85 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.165 176.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.666 ' O ' HG12 ' A' ' 937' ' ' ILE . 10.0 mmpt? -70.3 -19.03 63.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.102 0.477 . . . . 0.0 110.435 177.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.728 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.63 -25.33 33.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.92 0.39 . . . . 0.0 110.623 175.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.587 ' O ' ' HB3' ' A' ' 939' ' ' MET . 11.1 p -86.41 -10.09 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.927 172.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 934' ' ' LYS . 5.6 pt -83.48 -27.24 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 165.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.3 mt-10 -57.64 -39.29 76.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 164.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.613 ' HG2' ' SD ' ' A' ' 954' ' ' MET . 1.7 tmt? -57.07 -45.6 83.13 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.054 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 21.0 m -67.65 -30.06 69.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.99 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.1 m -79.62 -46.67 16.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.995 0.902 . . . . 0.0 108.677 -175.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.56 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 3.3 tmtm? -56.86 -45.61 82.35 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.366 -1.743 . . . . 0.0 110.786 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.1 tt -67.69 -30.34 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 O-C-N 123.302 0.376 . . . . 0.0 111.772 -176.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.803 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.4 mt-30 -50.09 -60.01 5.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.762 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 77.5 Cg_endo -97.37 34.8 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.513 1.475 . . . . 0.0 112.935 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -120.43 141.37 31.88 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 86.7 Cg_endo -88.7 -179.33 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 123.19 2.593 . . . . 0.0 109.718 165.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.638 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 9.1 Cg_endo -50.87 -32.37 37.24 Favored 'Trans proline' 0 C--O 1.247 0.932 0 C-N-CA 122.5 2.134 . . . . 0.0 112.451 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.6 -43.7 72.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.962 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.675 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.8 mp0 -95.71 1.72 53.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.537 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.638 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 5.9 m-30 -61.01 -48.25 82.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.519 -0.473 . . . . 0.0 109.786 176.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.027 HG13 ' HD3' ' A' ' 953' ' ' PRO . 1.3 p -75.72 -42.71 3.86 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.294 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.027 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.5 Cg_exo -52.68 -30.69 47.08 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.459 2.106 . . . . 0.0 113.753 168.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 33.8 ttp -56.88 -54.13 50.03 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 122.119 0.962 . . . . 0.0 109.189 174.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.537 HG11 ' HA ' ' A' ' 999' ' ' ILE . 42.0 t -60.64 -28.17 42.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.33 172.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 82.0 tttt -59.37 -38.28 80.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.485 ' OE1' ' HB3' ' A' ' 938' ' ' GLU . 38.9 mt-10 -59.11 -46.0 89.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.248 176.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.841 HG21 HD21 ' A' 1028 ' ' LEU . 10.0 p -75.11 -22.08 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 120.116 -0.633 . . . . 0.0 111.416 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.424 ' HA2' ' CD1' ' A' ' 995' ' ' LEU . . . -71.89 -43.83 48.72 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.646 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.78 -23.69 65.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.025 0.44 . . . . 0.0 110.732 172.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.42 -55.67 30.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.846 175.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.548 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 35.0 tp -64.37 -35.02 79.52 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.165 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 10.2 tpt180 -55.07 -57.73 10.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.187 0.518 . . . . 0.0 111.195 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 12.7 m -57.34 -38.14 73.65 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 110.646 175.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.799 HD21 HD23 ' A' 1035 ' ' LEU . 56.1 tp -64.64 -28.07 69.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.069 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.447 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 54.2 tp -62.29 -33.19 74.18 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.69 93.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.198 0.523 . . . . 0.0 110.034 172.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.672 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.8 m -67.59 -37.91 83.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.882 173.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 965' ' ' LEU . 93.8 t -56.47 -30.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.204 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.606 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.4 t70 -77.64 -22.29 50.93 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.429 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.633 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 41.8 mm-40 -71.82 -50.41 29.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 122.718 1.247 . . . . 0.0 108.499 170.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.635 ' OG ' HG21 ' A' ' 980' ' ' THR . 47.8 t -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.685 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.757 ' HA ' HD23 ' A' ' 976' ' ' LEU . 7.4 tt -60.87 -54.39 54.86 Favored Pre-proline 0 C--O 1.213 -0.827 0 CA-C-O 118.445 -0.788 . . . . 0.0 112.156 -176.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 38.0 Cg_exo -59.5 -27.49 85.09 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 121.613 1.612 . . . . 0.0 110.486 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.1 t -75.72 -14.2 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.982 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.954 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.6 pp -76.81 -41.98 2.77 Favored Pre-proline 0 CA--C 1.539 0.529 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.762 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.954 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 17.2 Cg_exo -69.03 -28.98 28.09 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.068 1.417 . . . . 0.0 110.118 172.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.32 -55.75 28.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.23 171.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.838 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 38.6 m -162.7 -42.04 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.833 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 93.6 m -51.53 -26.99 9.52 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -171.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.721 ' HA ' HG22 ' A' ' 984' ' ' ILE . 11.6 p80 -50.97 -39.12 54.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.1 0.864 . . . . 0.0 112.723 -165.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.4 mtm180 -53.73 -50.85 65.04 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.537 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.831 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.7 -48.35 32.73 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.841 -178.611 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.721 HG22 ' HA ' ' A' ' 981' ' ' HIS . 9.7 tp -60.4 -30.2 45.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.162 -174.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.65 -35.86 75.57 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.027 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.669 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 15.6 ptm -66.78 -52.69 41.12 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.455 -176.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.711 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -80.41 -44.75 18.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -174.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.474 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -64.24 -35.29 80.32 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.033 -173.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -66.11 -42.49 89.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.415 0.626 . . . . 0.0 109.515 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -49.56 75.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.261 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.645 HD21 HD22 ' A' 1035 ' ' LEU . 2.4 pp -73.92 -29.39 62.02 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -173.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.524 ' N ' HD12 ' A' ' 991' ' ' LEU . 6.8 t30 -57.81 -43.34 85.65 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 m -76.6 -25.21 53.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.92 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -101.29 -45.56 5.3 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -172.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.935 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.31 -52.7 62.6 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.334 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.53 -43.99 80.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.517 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' 1001 ' ' LYS . 62.1 tt0 -54.23 -41.06 68.27 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.548 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.647 HD12 ' HB3' ' A' 1001 ' ' LYS . 46.0 tp -70.05 -31.22 68.73 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.693 -175.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' 1003 ' ' LYS . 59.3 mt -58.96 -35.05 54.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.332 0.586 . . . . 0.0 109.862 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.452 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 35.5 m-80 -95.66 -10.16 30.12 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.771 178.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.647 ' HB3' HD12 ' A' ' 998' ' ' LEU . 27.1 tptt -82.75 -48.4 10.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.594 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 7.8 tpt -79.58 -26.39 41.32 Favored 'General case' 0 N--CA 1.438 -1.037 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.223 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.715 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.5 tttm -56.16 -48.96 75.31 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 168.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.449 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 31.7 tp -58.31 -43.73 88.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.351 174.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -64.16 -42.08 96.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.05 0.452 . . . . 0.0 110.926 178.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.54 -12.54 60.04 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.218 177.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.715 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.1 tp60 -85.09 -23.27 28.57 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.563 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.537 ' CE2' ' HB3' ' A' 1013 ' ' LEU . 0.1 OUTLIER -85.3 -56.73 3.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.042 176.353 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 9.2 p 34.39 67.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 124.651 1.219 . . . . 0.0 112.92 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.924 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 26.4 mmt -121.76 153.41 38.31 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.012 -0.994 . . . . 0.0 108.74 176.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 32.9 p -52.26 -56.35 15.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -170.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.6 p -99.07 -20.23 16.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 111.446 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.924 ' HB2' ' HB2' ' A' 1010 ' ' MET . 2.9 mm? -86.21 -20.05 29.1 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -174.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.596 ' HB2' ' O ' ' A' 1010 ' ' MET . 0.2 OUTLIER -61.57 -48.72 79.71 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.065 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -60.3 -37.4 80.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.809 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' 1020 ' ' GLN . 15.0 tp10 -50.78 -50.38 56.19 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.673 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.479 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.32 -25.57 61.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.792 0.33 . . . . 0.0 111.445 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' 1021 ' ' MET . 62.1 tttm -70.2 -36.04 74.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.319 0.581 . . . . 0.0 109.848 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 78.2 tttt -65.82 -29.75 70.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.267 174.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' 1016 ' ' GLU . 79.1 mt-30 -83.84 -38.33 21.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.992 -176.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -71.59 -25.94 62.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.854 177.611 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.9 tm? -64.82 -42.18 95.17 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 16.7 m -58.91 -35.55 73.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.452 176.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' 1001 ' ' LYS . . . -79.06 -38.82 35.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.441 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -61.69 -32.65 72.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.098 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.512 ' O ' HG23 ' A' 1030 ' ' VAL . 77.9 t60 -72.9 -40.89 65.18 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.151 176.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.28 -37.6 87.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.204 0.526 . . . . 0.0 109.851 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.935 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -60.2 -50.33 74.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.583 173.568 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.11 70.38 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.374 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' 1026 ' ' HIS . 97.5 t -65.75 -33.15 61.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.689 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.81 -39.32 73.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.857 -0.737 . . . . 0.0 109.948 -177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.793 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.15 -53.69 51.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.54 170.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.813 ' HA ' HD23 ' A' 1036 ' ' LEU . 96.9 mttt -63.77 -32.47 73.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -175.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' 1038 ' ' VAL . 13.2 t-20 -69.79 -36.88 76.07 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.006 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.799 HD23 HD21 ' A' ' 965' ' ' LEU . 13.6 tp -77.65 -24.17 49.51 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.486 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.891 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.5 OUTLIER -59.42 -43.76 93.0 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' 1041 ' ' GLN . 33.6 t70 -73.94 -22.6 59.6 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.217 177.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.831 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 15.1 t -76.89 -46.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.855 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.936 HD11 ' HB ' ' A' ' 929' ' ' VAL . 8.0 pt -92.62 -31.69 4.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -175.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.578 ' HB3' ' O ' ' A' 1036 ' ' LEU . 0.5 OUTLIER -54.1 -48.43 70.71 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 163.936 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.645 ' HG2' HD12 ' A' 1044 ' ' LEU . 88.5 mt-30 -75.37 -22.33 57.6 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 115.063 -0.972 . . . . 0.0 111.201 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.712 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.4 -52.75 62.53 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.382 0.611 . . . . 0.0 110.255 165.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.748 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 1.2 mpt_? -59.39 -28.26 66.73 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.74 173.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.645 HD12 ' HG2' ' A' 1041 ' ' GLN . 84.0 mt -78.76 -23.37 45.38 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.108 173.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.838 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 48.6 mmtm -63.28 -36.21 82.93 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 2.0 tmt? -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.268 176.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.5 -38.93 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.685 172.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.7 m -64.53 -41.45 96.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.601 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -73.51 -44.82 56.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.057 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 22.7 t -68.61 -34.86 76.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.014 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 63.44 92.7 0.06 OUTLIER Pre-proline 0 N--CA 1.463 0.222 0 O-C-N 123.581 0.551 . . . . 0.0 111.438 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.481 ' HG2' ' CD2' ' A' 1053 ' ' HIS . 72.4 Cg_endo -79.38 -7.16 14.92 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.377 2.051 . . . . 0.0 111.242 174.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.481 ' CD2' ' HG2' ' A' 1052 ' ' PRO . 6.2 p80 . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.817 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB2' HG13 ' A' 1047 ' ' ILE . 3.8 tpt180 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 29.9 m -85.49 27.62 0.82 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.629 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.61 68.76 0.78 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.862 0.865 . . . . 0.0 112.148 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.747 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.3 t70 -47.68 -171.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.497 -2.138 . . . . 0.0 112.511 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.0 tmtm? -27.92 -26.9 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.16 1.384 . . . . 0.0 113.8 177.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.846 HG21 ' HB2' ' A' 1043 ' ' ARG . 3.9 m -57.33 -52.65 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 174.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -77.28 -26.21 52.15 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 34.0 mt-10 -66.79 -62.28 1.53 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.761 -1.108 . . . . 0.0 112.097 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.483 ' HB2' ' CD ' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.91 -32.53 67.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.788 -0.187 . . . . 0.0 111.141 -172.452 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.952 HG11 ' HA ' ' A' 1036 ' ' LEU . 10.7 p -61.38 -31.76 51.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.888 175.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.574 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.6 m -63.46 -38.08 89.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 169.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 931' ' ' GLY . . . . . 0.455 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -59.09 -27.63 62.78 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.865 173.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.953 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 15.7 tp -66.03 -34.35 77.88 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.607 ' O ' HG12 ' A' ' 937' ' ' ILE . 57.7 t -77.01 -37.7 26.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.293 173.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.5 mmpt? -58.85 -37.57 76.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.155 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 1.116 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.1 -24.64 40.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.708 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.589 HG12 ' HA ' ' A' ' 933' ' ' VAL . 14.5 p -79.47 -15.33 13.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.045 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 933' ' ' VAL . 44.1 mm -74.62 -38.53 45.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 165.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.655 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 19.2 mm-40 -52.45 -46.28 66.39 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 167.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.607 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 29.3 ttp -58.32 -37.0 74.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.667 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.59 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 46.1 m -74.29 -37.96 63.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.625 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.503 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 28.3 m -78.82 -44.27 23.43 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.979 0.895 . . . . 0.0 109.452 -175.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.717 ' HD2' ' HB2' ' A' ' 954' ' ' MET . 4.5 tmtm? -59.89 -34.75 73.58 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.383 -178.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.553 HD12 ' HE1' ' A' ' 954' ' ' MET . 7.6 tt -77.35 -24.99 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 O-C-N 123.0 0.187 . . . . 0.0 111.143 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.743 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 87.1 mm-40 -51.39 -55.65 27.18 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.575 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.743 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.8 Cg_endo -99.89 31.59 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.148 1.899 . . . . 0.0 112.697 175.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -102.87 126.27 33.09 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -172.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.412 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 67.7 Cg_endo -77.26 171.88 17.0 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.75 2.3 . . . . 0.0 109.298 160.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.569 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 6.3 Cg_endo -50.01 -38.71 49.76 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 122.581 2.188 . . . . 0.0 112.689 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.06 -23.95 65.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.668 ' HB3' ' HE3' ' A' ' 942' ' ' LYS . 20.4 mm-40 -102.39 -15.66 16.46 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.327 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB2' ' HG3' ' A' 1006 ' ' GLN . 26.8 m-85 -55.03 -51.44 66.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.295 0.569 . . . . 0.0 109.644 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -66.91 -42.75 44.69 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.728 -178.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 73.8 Cg_exo -58.26 -35.1 99.04 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 121.639 1.559 . . . . 0.0 113.555 168.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.717 ' HB2' ' HD2' ' A' ' 942' ' ' LYS . 0.3 OUTLIER -62.44 -50.19 72.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.865 0.84 . . . . 0.0 109.737 177.492 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.615 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -60.41 -26.32 36.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.22 172.516 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 2.6 ttpm? -66.37 -35.16 79.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.8 mm-40 -56.51 -46.73 80.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.049 178.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.568 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 12.2 p -69.71 -22.64 25.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.957 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.417 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -69.24 -43.31 71.7 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.116 -1.04 . . . . 0.0 111.507 175.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.83 -22.2 65.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 111.067 172.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 1.116 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -63.47 -57.63 9.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.251 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 965' ' ' LEU . 16.9 tp -68.82 -32.55 72.33 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.495 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -57.48 -60.5 3.55 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.427 HG22 ' OD1' ' A' ' 928' ' ' ASN . 22.5 m -55.31 -34.8 64.48 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.848 0.832 . . . . 0.0 110.293 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 962' ' ' LEU . 2.6 tm? -64.52 -28.73 69.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.577 176.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 85.8 mt -67.5 -28.96 68.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.612 0.244 . . . . 0.0 110.654 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.56 -42.91 98.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.439 0.638 . . . . 0.0 109.497 172.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.783 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.8 m -62.36 -40.04 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.927 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.844 HG13 HD11 ' A' ' 984' ' ' ILE . 54.4 t -55.62 -31.26 28.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.197 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.563 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.0 t70 -74.46 -22.42 59.11 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.636 0.255 . . . . 0.0 110.97 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.63 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 59.6 mm-40 -71.95 -46.53 57.12 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 122.635 1.207 . . . . 0.0 109.317 169.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.438 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 28.5 t -66.32 -24.64 66.57 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.59 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.625 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.0 tp -60.57 -50.14 86.81 Favored Pre-proline 0 C--O 1.22 -0.498 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.248 -177.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.63 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.6 Cg_exo -58.12 -28.27 83.06 Favored 'Trans proline' 0 C--N 1.358 1.062 0 CA-C-N 121.02 1.4 . . . . 0.0 110.868 169.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.612 HG11 ' O ' ' A' 1042 ' ' ALA . 40.9 t -74.45 -15.76 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.547 176.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.767 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 2.2 tt -67.92 -52.72 23.24 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.157 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 35.8 Cg_exo -61.62 -29.07 83.52 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.155 1.237 . . . . 0.0 110.719 172.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -66.52 -59.39 3.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.392 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.557 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 68.8 m -163.9 -39.03 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -173.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 976' ' ' LEU . 2.0 t -62.11 -16.14 50.36 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -169.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.767 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 35.7 t60 -48.44 -21.55 0.57 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.806 0.443 . . . . 0.0 112.073 -177.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 11.1 tpp180 -77.66 -54.36 6.47 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.324 0.583 . . . . 0.0 110.379 176.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.887 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.65 -46.54 25.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.312 -176.022 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.844 HD11 HG13 ' A' ' 969' ' ' VAL . 12.6 tt -57.8 -32.96 44.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.228 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.58 -35.26 67.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.363 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.716 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.1 ptp -61.53 -61.5 2.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.746 -176.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.726 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.42 -34.94 31.24 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.504 ' NE2' HG11 ' A' ' 969' ' ' VAL . 45.2 tt0 -64.05 -47.76 78.91 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.59 0.632 . . . . 0.0 111.25 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -68.56 -27.9 66.48 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.529 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 7.3 tp -63.65 -42.99 98.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.857 176.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.726 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 92.6 mt -68.13 -31.29 70.78 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.035 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -56.4 -47.18 79.51 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -31.42 58.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.715 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.568 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.7 p30 -91.37 -52.09 4.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 120.069 -0.652 . . . . 0.0 112.435 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.039 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.05 -52.03 59.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.886 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.7 87.78 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.18 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 7.8 pt-20 -65.11 -32.6 74.38 Favored 'General case' 0 C--O 1.212 -0.909 0 C-N-CA 119.164 -1.015 . . . . 0.0 110.581 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.683 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 3.0 mm? -66.38 -41.86 88.77 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.647 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.506 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.3 mt -52.99 -40.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.981 173.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.508 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 51.3 m-20 -88.41 -10.07 50.49 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.343 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.683 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -85.77 -39.26 17.32 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.786 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.691 ' SD ' ' HD2' ' A' ' 951' ' ' TYR . 0.1 OUTLIER -78.72 -36.57 43.16 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 174.601 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.692 ' O ' ' HB2' ' A' 1007 ' ' GLN . 76.0 tttt -60.48 -52.48 65.02 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.139 173.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 13.7 mt -57.47 -41.17 80.11 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 174.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.796 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -61.62 -45.8 92.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 0.0 110.496 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.739 ' HG3' ' HB2' ' A' ' 951' ' ' TYR . 11.7 mm-40 -77.63 -9.55 59.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.733 0.778 . . . . 0.0 110.34 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.692 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.4 OUTLIER -87.55 -5.31 58.82 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.256 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.563 ' CE2' ' HB3' ' A' 1013 ' ' LEU . 79.5 t80 -126.54 2.64 6.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.784 179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.767 HG23 ' HG3' ' A' 1014 ' ' GLN . 7.4 p -53.0 117.32 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.897 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 48.0 tpp -132.49 -78.5 0.5 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.593 174.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 4.3 p -144.19 -97.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.936 176.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 47.4 t -72.26 -27.17 62.32 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 174.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.626 ' H ' HD12 ' A' 1013 ' ' LEU . 5.4 mp -59.24 -31.35 68.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.631 177.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.767 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.5 OUTLIER -63.74 -50.78 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.473 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -60.88 -37.73 83.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.482 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -49.88 -50.03 47.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 173.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.796 ' HD2' ' HA ' ' A' 1005 ' ' ALA . 1.1 m-30 -71.04 -28.15 64.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.559 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -74.86 -25.12 58.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.207 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 46.4 tttp -65.86 -61.0 2.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.173 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.03 -41.83 26.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.759 168.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.625 ' HG3' ' HE3' ' A' 1002 ' ' MET . 1.8 tmt? -63.42 -44.64 94.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.837 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 50.8 tp -60.5 -37.66 81.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.779 0.324 . . . . 0.0 111.42 -177.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 25.9 m -68.93 -31.77 70.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.573 0.702 . . . . 0.0 110.15 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.403 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -79.25 -39.26 33.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.86 -178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.455 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -63.84 -36.28 83.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.758 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 63.6 t60 -66.52 -31.16 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.493 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.94 -50.54 55.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.375 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.039 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.97 -32.07 73.07 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.15 0.5 . . . . 0.0 109.755 -175.335 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.63 ' N ' HD23 ' A' 1028 ' ' LEU . . . -61.69 -44.84 96.17 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.091 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 64.5 t -77.25 -18.99 14.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.547 ' C ' HD21 ' A' ' 991' ' ' LEU . 69.3 m-20 -85.73 -34.42 21.23 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.702 176.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.633 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -53.83 -49.14 69.06 Favored 'General case' 0 C--N 1.345 0.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 161.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.763 ' HA ' HD23 ' A' 1036 ' ' LEU . 56.8 tttm -61.14 -28.38 69.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.638 177.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.587 ' O ' HG23 ' A' 1038 ' ' VAL . 67.2 t30 -74.74 -34.32 62.5 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.9 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.705 ' CD2' HD11 ' A' ' 965' ' ' LEU . 25.1 tp -78.09 -23.69 47.86 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.688 -177.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.952 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.2 pp -63.6 -43.27 97.39 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.415 ' N ' HD12 ' A' 1036 ' ' LEU . 16.5 t70 -62.68 -43.73 98.05 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.101 175.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.887 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 44.2 t -53.4 -69.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.575 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.931 HD11 ' HB ' ' A' ' 929' ' ' VAL . 7.1 pt -77.94 -26.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.2 t70 -49.94 -48.21 52.05 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 163.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.424 ' O ' ' N ' ' A' 1045 ' ' LYS . 96.7 mt-30 -78.72 -24.54 44.87 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.192 177.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.719 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.88 -56.01 24.16 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 118.921 0.782 . . . . 0.0 111.537 171.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.846 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.0 OUTLIER -55.68 -30.38 60.97 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.564 176.194 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 41.6 tp -74.77 -37.27 62.49 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.591 172.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 13.6 mptt -53.68 -38.98 64.74 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.018 0.927 . . . . 0.0 109.869 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.8 ttt -60.54 -44.59 95.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.583 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 920' ' ' ARG . 43.3 mm -70.52 -28.7 35.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.448 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 67.8 m -58.9 -54.65 44.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.412 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -80.06 -12.34 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.34 0.591 . . . . 0.0 110.114 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.534 ' O ' ' HD3' ' A' 1052 ' ' PRO . 28.3 t -83.51 -1.03 52.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.561 0.696 . . . . 0.0 109.608 173.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -107.26 92.06 7.57 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.818 175.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.534 ' HD3' ' O ' ' A' 1050 ' ' SER . 16.6 Cg_exo -69.1 136.3 34.37 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.478 2.118 . . . . 0.0 111.279 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 57.9 m-70 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.309 -0.853 . . . . 0.0 109.542 178.536 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.871 ' HD3' ' HB2' ' A' 1044 ' ' LEU . 2.0 ttt-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 43.5 t 62.66 10.3 4.07 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 122.703 0.401 . . . . 0.0 111.695 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 46.02 52.74 9.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 123.364 0.666 . . . . 0.0 110.85 -176.146 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.485 ' O ' ' N ' ' A' ' 925' ' ' VAL . 9.4 t70 -45.58 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 125.817 1.948 . . . . 0.0 112.182 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.6 tmtp? -44.82 -14.18 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.515 0.726 . . . . 0.0 111.722 -178.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.833 ' HA ' HG23 ' A' ' 968' ' ' THR . 9.8 m -63.15 -53.3 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.15 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.573 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 59.2 t80 -77.62 -28.35 51.43 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.661 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.6 mt-10 -62.71 -66.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.175 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.525 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.5 t30 -66.71 -36.17 81.85 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.264 -172.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.861 ' HA ' HD13 ' A' ' 932' ' ' LEU . 9.9 p -61.66 -39.48 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 120.932 0.396 . . . . 0.0 111.339 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.564 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 59.9 m -66.24 -33.36 75.57 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.26 -30.04 60.76 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 114.55 -1.204 . . . . 0.0 112.757 172.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 1.041 HD11 ' HB2' ' A' ' 965' ' ' LEU . 6.9 mp -63.04 -45.85 90.33 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 117.941 0.871 . . . . 0.0 109.622 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 936' ' ' VAL . 61.8 t -63.21 -37.34 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.648 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -68.4 -31.57 71.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.209 0.528 . . . . 0.0 110.373 175.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -77.56 -25.32 49.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.563 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -81.3 -6.71 10.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 119.714 -0.794 . . . . 0.0 109.34 172.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.564 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 66.1 mt -75.91 -33.75 26.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 165.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 24.6 mm-40 -53.24 -40.7 64.79 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.66 168.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.918 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.5 tmm? -58.12 -46.9 84.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.941 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.601 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 46.9 m -64.08 -33.08 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.201 179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.716 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 13.3 m -77.46 -45.49 25.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.953 0.882 . . . . 0.0 108.938 -176.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.554 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 8.5 mmtp -55.94 -47.1 78.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.063 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.615 ' HA ' ' OE1' ' A' ' 950' ' ' GLU . 10.9 tt -68.89 -28.89 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.515 -174.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.625 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 75.8 mt-30 -53.28 -62.03 4.12 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.716 ' HD3' ' O ' ' A' ' 941' ' ' SER . 5.7 Cg_exo -77.64 -35.69 1.44 Allowed 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.703 1.602 . . . . 0.0 114.88 -170.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.441 ' HB3' ' CG ' ' A' ' 950' ' ' GLU . . . -105.92 164.21 15.47 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -167.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.642 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 10.8 Cg_exo -74.26 179.99 5.29 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 123.845 3.03 . . . . 0.0 110.94 169.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.69 -15.56 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 124.134 3.223 . . . . 0.0 115.323 -171.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 7.0 pt-20 -57.72 -20.07 31.91 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.395 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.642 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.2 OUTLIER -87.78 -22.01 24.78 Favored 'General case' 0 CA--C 1.511 -0.524 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.659 174.288 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.712 ' HD2' ' HA ' ' A' 1002 ' ' MET . 0.3 OUTLIER -56.22 -50.47 71.18 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 123.814 0.697 . . . . 0.0 110.245 -172.246 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.993 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -75.11 -45.04 4.74 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.635 178.574 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.993 ' HD3' HG13 ' A' ' 952' ' ' VAL . 85.4 Cg_exo -56.74 -27.49 71.3 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 121.599 1.532 . . . . 0.0 114.731 172.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.918 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 26.4 ptt? -74.61 -35.68 62.94 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.758 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 1.053 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -63.21 -27.49 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.473 170.543 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.72 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.7 ttpp -56.07 -41.73 75.55 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.1 mm-40 -58.26 -46.25 86.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.36 -1.291 . . . . 0.0 111.558 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.563 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.3 m -74.36 -28.46 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.8 -42.35 38.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.048 -1.073 . . . . 0.0 111.861 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 57.2 tp -58.61 -34.52 71.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.244 0.545 . . . . 0.0 109.595 171.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.61 -48.42 81.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.736 174.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 17.9 tp -68.7 -36.85 78.99 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.726 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 46.6 ttp180 -63.77 -47.9 79.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.605 -0.684 . . . . 0.0 111.595 176.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 p -56.81 -35.7 69.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.318 0.58 . . . . 0.0 109.869 171.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 1.041 ' HB2' HD11 ' A' ' 932' ' ' LEU . 63.7 tp -64.41 -34.51 78.34 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.84 176.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 88.5 mt -58.25 -33.82 69.79 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.099 178.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.4 -43.06 91.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.63 0.728 . . . . 0.0 109.647 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.833 HG23 ' HA ' ' A' ' 925' ' ' VAL . 6.2 m -60.29 -43.4 96.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.861 173.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.568 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 76.3 t -55.3 -35.99 38.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.905 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.654 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 16.2 t70 -71.63 -22.33 61.71 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 120.504 0.193 . . . . 0.0 111.447 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 975' ' ' VAL . 7.2 mm-40 -70.06 -47.87 60.18 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 122.838 1.304 . . . . 0.0 108.379 170.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.625 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.7 t -67.83 -25.44 65.56 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.657 -1.611 . . . . 0.0 111.67 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.631 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.6 mt -63.16 -51.34 70.38 Favored Pre-proline 0 C--O 1.218 -0.579 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.654 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.6 Cg_endo -57.48 -29.42 84.64 Favored 'Trans proline' 0 C--N 1.352 0.762 0 CA-C-N 121.594 1.605 . . . . 0.0 110.729 169.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' 1042 ' ' ALA . 2.5 t -76.76 -11.29 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 119.899 -0.721 . . . . 0.0 110.885 175.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.631 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.2 tt -65.19 -56.08 22.22 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.796 176.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 976' ' ' LEU . 31.5 Cg_exo -60.5 -31.99 93.11 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 121.297 1.331 . . . . 0.0 110.628 174.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.05 -53.06 61.82 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.315 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.779 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.3 m -169.33 -38.32 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.699 HG22 ' HB ' ' A' ' 984' ' ' ILE . 5.5 m -57.04 -17.42 10.07 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.593 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 13.7 p-80 -48.6 -18.84 0.28 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -77.62 -54.89 5.85 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.059 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.056 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.8 OUTLIER -79.84 -44.21 20.93 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.315 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.699 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -59.25 -33.33 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -173.67 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.37 -36.05 68.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.661 174.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptm -67.34 -56.24 10.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.78 -176.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.576 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.66 -39.94 23.61 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 1.071 ' HA ' HD12 ' A' ' 991' ' ' LEU . 25.0 tm0? -67.47 -38.99 85.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.688 -173.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -72.5 -24.67 61.19 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.479 0.657 . . . . 0.0 109.268 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.4 tp -72.79 -41.13 65.3 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.561 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.071 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.5 mt -59.01 -50.51 73.82 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.216 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.42 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 27.9 t-20 -55.5 -38.83 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.818 -178.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -67.51 -38.77 84.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.408 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.703 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -113.31 -30.13 7.01 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -170.669 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.082 ' HA ' HD12 ' A' 1028 ' ' LEU . 4.2 mm? -55.95 -51.16 68.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 166.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.767 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -60.65 -44.33 96.54 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.582 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.597 ' HG3' ' HE2' ' A' 1001 ' ' LYS . 6.3 tp10 -51.97 -42.93 63.29 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.983 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.695 ' O ' ' HG2' ' A' 1002 ' ' MET . 3.8 mm? -70.94 -33.1 70.17 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.568 -175.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.777 ' HA ' HG11 ' A' ' 955' ' ' VAL . 8.2 pt -62.65 -23.57 33.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.095 177.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.745 ' O ' ' HB2' ' A' 1004 ' ' LEU . 17.0 m-80 -94.52 -10.3 32.64 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.262 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.597 ' HE2' ' HG3' ' A' ' 997' ' ' GLU . 73.0 mmtt -83.36 -40.14 19.81 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.053 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 8.6 mmt -70.81 -44.2 67.06 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.732 ' O ' ' HB2' ' A' 1007 ' ' GLN . 86.2 tttt -57.62 -45.69 85.07 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.464 173.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.745 ' HB2' ' O ' ' A' 1000 ' ' ASN . 17.0 tp -55.09 -53.53 54.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.454 0.702 . . . . 0.0 112.824 172.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.25 -41.74 93.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.077 0.465 . . . . 0.0 110.58 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.06 -18.05 59.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.555 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.732 ' HB2' ' O ' ' A' 1003 ' ' LYS . 28.6 tp60 -75.94 -41.03 52.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.362 178.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.59 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.9 OUTLIER -71.04 -54.6 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.354 176.527 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.405 ' O ' HG13 ' A' 1009 ' ' VAL . 9.1 p 34.15 78.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.679 1.237 . . . . 0.0 113.053 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.569 ' H ' ' HB2' ' A' 1014 ' ' GLN . 22.8 ttt -135.65 124.31 23.76 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.2 t -39.2 -49.41 1.86 Allowed 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -166.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 7.9 t -99.69 -35.66 9.74 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 121.703 -0.623 . . . . 0.0 111.608 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.09 -9.81 57.52 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -171.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.574 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? -64.01 -30.93 71.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.795 0.331 . . . . 0.0 110.121 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.577 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 14.5 mp0 -61.7 -33.37 73.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.765 -176.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.73 -47.75 50.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.682 0.277 . . . . 0.0 111.232 169.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.625 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.9 m-30 -76.12 -22.09 55.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.195 0.521 . . . . 0.0 110.508 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.685 ' HG3' ' OH ' ' A' ' 951' ' ' TYR . 75.7 tttt -73.03 -41.81 63.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.164 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.84 -18.64 61.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.962 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -77.24 -40.57 44.33 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' SD ' ' A' 1002 ' ' MET . 1.5 tmt? -66.04 -38.83 89.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.869 174.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 7.6 tt -55.38 -50.8 68.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.895 0.379 . . . . 0.0 110.405 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 13.1 m -67.62 -34.64 77.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.486 0.66 . . . . 0.0 110.808 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -74.36 -37.49 63.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.097 -176.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -66.26 -32.04 73.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.649 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' 1030 ' ' VAL . 12.0 t-80 -66.67 -32.49 73.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.4 -50.97 57.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.923 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.082 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -67.4 -30.7 70.53 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.261 0.553 . . . . 0.0 110.304 -178.168 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.647 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.52 -41.41 76.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.853 170.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' 1026 ' ' HIS . 88.8 t -66.67 -31.12 52.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.649 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.703 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 5.8 m-20 -59.07 -47.48 85.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.046 0.45 . . . . 0.0 109.961 176.027 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.12 87.19 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.567 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.759 ' O ' ' HG ' ' A' 1036 ' ' LEU . 31.0 mmmt -63.31 -36.63 84.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.123 0.487 . . . . 0.0 111.358 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' 1038 ' ' VAL . 4.4 t-20 -68.71 -39.67 80.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.381 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 991' ' ' LEU . 12.1 tp -78.86 -22.23 46.35 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.866 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.778 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -67.95 -31.59 71.44 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' 1041 ' ' GLN . 28.3 t70 -75.89 -31.89 59.41 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.512 171.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.056 HG13 ' HB3' ' A' ' 983' ' ' GLU . 33.9 t -64.04 -67.31 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.297 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.749 HG12 ' O ' ' A' 1035 ' ' LEU . 7.7 pt -80.99 -32.23 12.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.061 -170.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.573 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 12.6 t0 -55.11 -45.93 75.52 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 166.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.65 ' HB2' ' O ' ' A' 1037 ' ' ASP . 2.7 mp0 -67.86 -28.65 67.72 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.147 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.63 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -52.81 -53.18 52.13 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-O 120.861 0.362 . . . . 0.0 111.063 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.453 ' HB3' ' HG3' ' A' ' 920' ' ' ARG . 0.9 OUTLIER -54.21 -36.6 63.64 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.008 176.052 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.871 ' HB2' ' HD3' ' A' ' 920' ' ' ARG . 14.6 tp -76.81 -25.25 53.07 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.982 -0.449 . . . . 0.0 111.539 173.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.779 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 25.0 mmtp -63.21 -21.39 66.19 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 172.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' 1043 ' ' ARG . 11.9 tmm? -74.89 -43.91 51.77 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.728 -1.123 . . . . 0.0 108.913 176.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.734 HG23 ' HA ' ' A' 1052 ' ' PRO . 3.9 mp -61.31 -41.57 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 121.609 0.719 . . . . 0.0 109.868 170.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.519 ' HB2' ' HA ' ' A' 1045 ' ' LYS . 32.8 m -69.35 -12.73 61.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.093 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.44 -69.39 0.41 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 7.1 t -176.35 29.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.387 . . . . 0.0 110.733 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' 1047 ' ' ILE . 71.5 ttt180 -144.87 97.96 4.86 Favored Pre-proline 0 C--N 1.324 -0.501 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.085 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.734 ' HA ' HG23 ' A' 1047 ' ' ILE . 17.4 Cg_exo -68.21 -26.9 35.62 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.753 2.302 . . . . 0.0 111.645 176.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 18.7 t-80 . . . . . 0 C--O 1.245 0.868 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.36 179.939 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.564 ' HG3' ' HB3' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 120.964 0.411 . . . . 0.0 110.17 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 17.7 p -91.31 25.38 2.58 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.551 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.559 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.28 54.71 7.02 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.218 -175.553 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.48 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -47.01 -173.27 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 125.763 1.914 . . . . 0.0 112.084 -176.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.597 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.0 tmtm? -39.01 -22.74 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.385 0.674 . . . . 0.0 111.685 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 1.022 ' HA ' HG23 ' A' ' 968' ' ' THR . 14.8 m -56.64 -52.82 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.599 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.437 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 12.9 t80 -77.91 -32.99 52.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 930' ' ' THR . 3.3 tt0 -61.19 -58.57 7.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 113.208 -1.815 . . . . 0.0 112.102 -174.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -71.99 -32.27 67.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.59 -172.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.619 ' HA ' HD12 ' A' ' 965' ' ' LEU . 39.9 t -63.33 -35.09 70.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.092 173.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.533 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -65.33 -39.05 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 169.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.07 -29.75 62.85 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.935 175.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.82 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 22.5 tp -65.39 -38.79 91.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.479 ' HA ' HG12 ' A' ' 936' ' ' VAL . 38.2 t -67.66 -40.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.13 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -61.8 -30.6 70.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.159 0.504 . . . . 0.0 110.107 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.6 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -76.65 -26.33 54.72 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.354 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.0 p -85.04 -4.97 9.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.899 0.857 . . . . 0.0 109.092 172.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 62.4 mt -81.46 -38.63 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 163.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 73.0 mm-40 -52.77 -40.28 63.0 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.364 167.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.705 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.26 -44.93 92.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.839 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.619 ' O ' HG22 ' A' ' 943' ' ' ILE . 5.0 p -74.57 -27.36 60.46 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.4 p -79.13 -44.98 20.93 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.694 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 0.1 OUTLIER -51.35 -43.53 61.83 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 113.304 -1.771 . . . . 0.0 110.889 172.765 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 940' ' ' SER . 0.3 OUTLIER -67.54 -29.37 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 O-C-N 123.841 0.713 . . . . 0.0 110.746 -175.498 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.821 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.8 mm-40 -52.01 -58.58 10.81 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-O 119.398 -0.334 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.821 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 56.6 Cg_endo -101.25 26.22 0.13 Allowed 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 121.884 1.723 . . . . 0.0 113.166 175.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.694 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -83.86 121.87 76.1 Favored Pre-proline 0 C--N 1.33 -0.249 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -174.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.768 ' HD2' ' HG3' ' A' ' 950' ' ' GLU . 92.7 Cg_endo -82.04 -176.2 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.814 2.343 . . . . 0.0 109.568 156.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.958 ' HA ' ' HD2' ' A' ' 951' ' ' TYR . 8.9 Cg_endo -51.71 -41.15 63.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.456 2.104 . . . . 0.0 112.743 177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -64.69 -7.41 10.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.021 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.768 ' HG3' ' HD2' ' A' ' 947' ' ' PRO . 5.9 mm-40 -109.46 -17.09 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.261 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.958 ' HD2' ' HA ' ' A' ' 948' ' ' PRO . 31.8 m-85 -59.42 -37.3 77.7 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.058 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.41 -50.41 2.77 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.621 177.875 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.058 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.1 Cg_exo -56.31 -36.74 97.36 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.727 2.284 . . . . 0.0 114.854 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.705 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.6 ptp -60.14 -47.52 85.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.747 0.784 . . . . 0.0 108.973 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' 1002 ' ' MET . 61.8 t -65.22 -28.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.334 172.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.0 tptm -62.06 -37.34 84.63 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.484 ' HG3' ' HB3' ' A' ' 938' ' ' GLU . 71.1 mm-40 -55.74 -47.14 77.44 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.608 174.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 1.004 HG21 HD23 ' A' ' 998' ' ' LEU . 3.6 m -72.47 -28.88 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.791 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.579 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.39 -44.92 32.12 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.063 -1.065 . . . . 0.0 111.783 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.65 -31.72 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.82 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.41 -55.23 36.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.531 178.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.675 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 4.6 tt -65.34 -32.77 74.58 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.327 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.485 ' HD3' ' HA ' ' A' ' 963' ' ' ARG . 30.8 mmt180 -65.02 -48.64 73.19 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 122.009 -0.432 . . . . 0.0 111.583 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.451 HG22 ' OD1' ' A' ' 928' ' ' ASN . 11.1 m -60.04 -37.46 79.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.358 0.599 . . . . 0.0 109.937 172.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 3.2 tt -59.03 -30.43 68.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.49 173.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.523 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 52.5 tp -66.6 -31.44 72.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 970' ' ' ASP . . . -65.65 -41.45 92.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.942 0.877 . . . . 0.0 109.658 173.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 968' ' ' THR . . . . . 1.022 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -60.96 -38.6 86.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.742 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 70.7 t -55.4 -30.79 26.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.001 171.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.656 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.7 t70 -65.45 -29.59 70.28 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 122.406 -0.184 . . . . 0.0 111.313 177.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.614 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 54.2 mm-40 -65.95 -52.11 52.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 122.293 1.044 . . . . 0.0 109.658 172.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.531 ' HB3' ' CG1' ' A' 1039 ' ' ILE . 60.7 p -66.35 -23.3 66.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.153 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.857 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 65.1 tp -58.66 -54.72 53.39 Favored Pre-proline 0 C--O 1.217 -0.606 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.656 ' HD3' ' O ' ' A' ' 970' ' ' ASP . 26.1 Cg_exo -64.86 -25.55 60.18 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.397 1.535 . . . . 0.0 110.319 172.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 971' ' ' GLU . 5.3 t -75.6 -16.37 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 119.909 -0.717 . . . . 0.0 111.5 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.857 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 4.6 pp -80.45 -38.48 1.09 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 118.344 -0.836 . . . . 0.0 113.001 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.734 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 21.9 Cg_exo -66.34 -26.63 48.28 Favored 'Trans proline' 0 C--N 1.36 1.132 0 CA-C-N 121.578 1.599 . . . . 0.0 110.0 171.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' 1049 ' ' GLN . . . -69.84 -51.82 30.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.266 173.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.8 m -162.57 -48.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.962 HG22 ' HB ' ' A' ' 984' ' ' ILE . 51.4 m -46.92 -20.45 0.14 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.653 ' HB2' ' O ' ' A' ' 976' ' ' LEU . 19.5 t-80 -51.72 -20.15 1.97 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -76.81 -54.45 6.6 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.941 -177.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.077 ' HB2' HG22 ' A' 1038 ' ' VAL . 7.9 pm0 -78.64 -37.39 42.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 121.813 -0.554 . . . . 0.0 111.839 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.962 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.8 tp -62.03 -21.88 27.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.45 -47.13 51.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.059 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.487 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 22.7 ptp -72.26 -46.26 56.63 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.768 -170.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.65 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.73 -45.55 20.95 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -175.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.98 ' HA ' HD12 ' A' ' 991' ' ' LEU . 46.3 tt0 -62.21 -43.68 98.29 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.178 -175.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.445 ' NZ ' ' HB3' ' A' ' 989' ' ' LYS . 9.8 mtpm? -66.63 -32.61 74.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.415 0.626 . . . . 0.0 109.474 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 3.3 tp -65.13 -43.72 91.01 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.378 177.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.05 HD23 ' HB3' ' A' 1031 ' ' ASP . 22.8 mt -60.0 -45.98 90.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.01 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.94 -41.55 71.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.654 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.1 m -73.04 -34.37 66.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.256 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.686 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -103.97 -31.67 9.62 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -170.407 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.857 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -57.93 -38.46 75.96 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 165.634 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -55.57 -48.98 73.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.685 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -65.75 -32.31 73.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.718 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 1.004 HD23 HG21 ' A' ' 958' ' ' VAL . 14.1 tp -71.34 -26.78 62.97 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 119.11 -1.036 . . . . 0.0 108.898 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HG2' ' A' 1002 ' ' MET . 64.4 mt -62.36 -27.14 42.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.375 0.607 . . . . 0.0 109.605 169.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 77.5 m-20 -80.68 -6.71 58.77 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.665 ' HA ' ' HG3' ' A' 1021 ' ' MET . 58.2 tttm -80.07 -45.24 18.62 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 172.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.893 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 17.7 ptp -64.34 -38.0 89.47 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 175.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.822 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.6 tttp -67.87 -61.94 1.64 Allowed 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.712 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.648 ' HB2' ' O ' ' A' 1000 ' ' ASN . 4.8 tp -56.49 -56.08 25.72 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -173.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.6 -46.62 83.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.16 0.505 . . . . 0.0 110.785 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -24.14 54.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.952 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.822 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -69.07 -46.08 68.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.825 -173.456 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.63 ' HB2' ' CE2' ' A' 1017 ' ' TYR . 0.0 OUTLIER -121.81 32.92 5.67 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.989 -0.684 . . . . 0.0 111.256 175.681 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.613 HG21 ' HB3' ' A' ' 948' ' ' PRO . 7.2 p -46.78 122.81 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.567 0.699 . . . . 0.0 110.991 173.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.88 ' H ' ' HB2' ' A' 1014 ' ' GLN . 0.4 OUTLIER -153.97 147.55 25.15 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -177.265 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 11.9 t -61.11 -6.87 2.2 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 46.7 t -135.32 -47.21 0.7 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.869 0.366 . . . . 0.0 111.222 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 7.5 mp -73.04 -20.71 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.88 ' HB2' ' H ' ' A' 1010 ' ' MET . 0.4 OUTLIER -56.77 -42.62 79.7 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.061 0.226 . . . . 0.0 111.498 -173.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -52.82 -38.27 61.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -165.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -47.19 -51.56 18.15 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.079 0.466 . . . . 0.0 111.684 171.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.641 ' HA ' HD23 ' A' 1004 ' ' LEU . 3.2 m-85 -68.33 -23.87 64.76 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.968 0.889 . . . . 0.0 109.204 -173.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.458 ' HE3' HD11 ' A' ' 943' ' ' ILE . 85.3 tttt -79.41 -41.66 27.17 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.05 176.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 79.0 tttt -77.96 -33.76 51.38 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.59 0.71 . . . . 0.0 111.643 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.01 -45.74 14.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.276 -0.874 . . . . 0.0 108.9 -171.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.665 ' HG3' ' HA ' ' A' 1001 ' ' LYS . 25.8 mmt -75.37 -17.74 60.14 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.824 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1018 ' ' LYS . 58.8 tp -63.45 -43.53 97.13 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 171.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.3 m -61.62 -28.65 69.52 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.3 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.82 -30.92 51.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.742 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -67.45 -40.61 85.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.327 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.534 ' O ' HG23 ' A' 1030 ' ' VAL . 14.8 t-80 -58.39 -38.02 76.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.103 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.0 -49.54 69.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.857 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -68.3 -29.05 67.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.34 0.59 . . . . 0.0 110.07 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.498 ' N ' HD23 ' A' 1028 ' ' LEU . . . -59.75 -42.68 93.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.604 172.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' 1026 ' ' HIS . 47.7 t -67.03 -31.4 53.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.957 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1031 ' ' ASP . . . . . 1.05 ' HB3' HD23 ' A' ' 991' ' ' LEU . 2.4 m-20 -56.19 -46.93 79.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.665 173.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.79 -53.53 57.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.313 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -54.1 -42.0 68.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.905 0.384 . . . . 0.0 111.646 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1034 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -63.72 -49.83 71.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.823 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.915 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -73.13 -27.57 61.75 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.468 ' N ' HG11 ' A' ' 929' ' ' VAL . 4.4 tt -57.5 -35.86 70.77 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.527 0.731 . . . . 0.0 110.737 177.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -92.51 -33.68 14.37 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.077 HG22 ' HB2' ' A' ' 983' ' ' GLU . 2.0 t -56.09 -46.57 80.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.367 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.2 tt -93.48 -28.51 4.38 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.938 -172.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 7.5 t70 -57.33 -42.81 82.61 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 161.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 15.2 mm100 -69.81 -31.44 69.35 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.707 174.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.588 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.82 -56.11 20.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.05 0.452 . . . . 0.0 110.553 171.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.2 tpt180 -57.29 -33.86 68.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.618 177.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.462 HD13 HH11 ' A' ' 920' ' ' ARG . 63.3 tp -69.01 -41.82 77.25 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 121.094 -0.243 . . . . 0.0 111.066 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.891 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 42.1 mmtm -51.09 -37.39 45.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.029 0.919 . . . . 0.0 110.079 174.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.435 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 28.0 ttt -68.82 -38.06 79.61 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.271 -1.331 . . . . 0.0 110.017 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.71 HG22 ' HG3' ' A' 1052 ' ' PRO . 42.8 mm -67.56 -36.3 75.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.38 173.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' 1045 ' ' LYS . 71.0 m -56.15 -51.39 68.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.305 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.664 ' HG3' ' HB1' ' A' ' 978' ' ' ALA . 15.8 mm100 -65.88 -30.14 70.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.219 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 22.0 m -79.51 -14.54 58.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.526 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.403 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 10.5 tpt180 66.03 106.44 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.498 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.71 ' HG3' HG22 ' A' 1047 ' ' ILE . 5.8 Cg_exo -77.24 -82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.637 2.224 . . . . 0.0 111.339 177.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 29.6 m170 . . . . . 0 C--O 1.243 0.73 0 CA-C-O 118.389 -0.815 . . . . 0.0 109.212 174.517 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.73 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.624 0.25 . . . . 0.0 110.791 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 28.4 t -68.89 139.09 55.13 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 166.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.657 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.0 OUTLIER -72.02 67.91 0.66 Allowed 'General case' 0 CA--C 1.499 -1.002 0 C-N-CA 122.538 0.335 . . . . 0.0 111.524 -173.463 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 925' ' ' VAL . 8.2 t70 -47.87 -173.92 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 O-C-N 125.902 2.001 . . . . 0.0 112.325 -173.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 5.1 tmtp? -39.27 -19.76 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 124.042 0.937 . . . . 0.0 112.508 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.959 ' HA ' HG23 ' A' ' 968' ' ' THR . 3.7 m -62.01 -57.16 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 123.037 0.535 . . . . 0.0 112.193 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 23.3 t80 -78.97 -31.28 44.87 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 122.206 1.003 . . . . 0.0 108.764 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 7.8 mm-40 -60.84 -59.49 5.3 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.953 -1.476 . . . . 0.0 112.188 -175.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 13.0 t-20 -73.65 -32.54 64.05 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.671 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.7 p -62.63 -37.11 78.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 119.904 -0.719 . . . . 0.0 110.423 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.529 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 31.0 m -66.65 -33.94 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.291 0.567 . . . . 0.0 109.586 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.27 -31.07 65.29 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.381 173.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.718 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 25.9 tp -62.99 -41.78 99.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.004 0.43 . . . . 0.0 109.886 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 937' ' ' ILE . 48.2 t -62.3 -43.02 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 0.0 110.011 174.081 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -55.95 -40.89 73.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.724 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.36 -31.63 62.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.864 -177.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.627 ' HA ' HG22 ' A' ' 958' ' ' VAL . 13.0 p -77.41 -16.8 14.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.441 174.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.5 mm -72.55 -42.46 63.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 165.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 45.1 mt-10 -54.44 -37.2 64.87 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.937 172.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.553 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 42.9 ttp -57.94 -45.86 85.94 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.626 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.5 t -72.48 -32.84 66.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.857 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 24.0 m -77.64 -47.01 20.33 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.999 0.905 . . . . 0.0 109.968 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.563 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -78.86 -15.94 57.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.477 -174.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.855 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 6.8 tt -78.99 -25.62 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.106 172.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.699 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.2 mm-40 -50.93 -53.72 44.81 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.1 Cg_endo -104.43 36.26 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.09 1.86 . . . . 0.0 114.319 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.726 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -138.16 155.53 74.26 Favored Pre-proline 0 N--CA 1.466 0.33 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.528 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 50.5 Cg_endo -90.47 -176.72 1.1 Allowed 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 124.043 3.162 . . . . 0.0 112.091 176.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.765 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.8 Cg_exo -51.96 -31.77 44.99 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.976 2.451 . . . . 0.0 113.086 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.421 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 47.1 mt-10 -53.99 -36.17 62.63 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.557 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.726 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.4 mp0 -98.65 0.09 44.03 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.765 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 15.8 m-30 -61.27 -41.21 96.55 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.0 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -75.02 -51.25 3.64 Favored Pre-proline 0 CA--C 1.557 1.212 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.729 176.05 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.991 ' HD3' HG13 ' A' ' 952' ' ' VAL . 79.9 Cg_exo -51.54 -33.74 49.19 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.408 2.072 . . . . 0.0 115.112 173.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.855 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 27.3 ptt? -67.48 -45.84 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.182 0.515 . . . . 0.0 109.997 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.691 HG13 ' HG ' ' A' ' 998' ' ' LEU . 87.2 t -64.67 -27.14 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.502 173.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.7 ttpm? -59.4 -37.02 76.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -54.69 -46.09 74.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.882 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.627 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.1 t -69.95 -36.23 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.851 176.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.639 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.02 -44.46 67.16 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.358 -0.925 . . . . 0.0 112.872 -176.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.21 -32.34 72.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.884 0.374 . . . . 0.0 110.486 171.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.19 -55.92 21.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.616 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 1.8 tm? -63.8 -35.03 79.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.527 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -57.42 -57.38 12.93 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 121.827 -0.546 . . . . 0.0 111.114 171.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -55.81 -31.07 62.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.367 0.603 . . . . 0.0 110.65 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' 1035 ' ' LEU . 2.5 tm? -65.56 -39.87 92.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.057 176.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.5 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 8.6 tt -54.75 -33.53 61.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.043 176.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.25 79.27 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 110.317 174.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.959 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.4 m -56.03 -40.75 73.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.837 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.667 HG13 HD11 ' A' ' 984' ' ' ILE . 79.1 t -54.2 -32.0 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.681 173.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.779 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 24.9 t70 -68.06 -32.37 72.66 Favored 'General case' 0 C--O 1.219 -0.506 0 O-C-N 122.472 -0.143 . . . . 0.0 111.01 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.63 -53.0 63.13 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.78 1.276 . . . . 0.0 108.575 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.577 ' OG ' HG21 ' A' ' 980' ' ' THR . 26.7 t -65.42 -22.35 66.76 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.106 -1.406 . . . . 0.0 112.176 178.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.643 ' O ' ' HD3' ' A' ' 977' ' ' PRO . 6.4 tt -59.73 -54.96 50.57 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.916 -177.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.779 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.8 Cg_endo -58.84 -22.42 62.18 Favored 'Trans proline' 0 C--N 1.357 1.007 0 CA-C-N 121.58 1.6 . . . . 0.0 111.133 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.587 HG12 ' HB ' ' A' ' 980' ' ' THR . 60.0 t -74.35 -16.44 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.038 173.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 1.002 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -75.19 -41.37 3.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.42 -0.8 . . . . 0.0 112.409 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 1.002 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 23.7 Cg_exo -65.69 -27.07 52.91 Favored 'Trans proline' 0 C--N 1.361 1.219 0 CA-C-N 120.957 1.378 . . . . 0.0 110.354 171.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.06 -60.49 2.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.775 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.565 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 37.4 m -166.56 -34.2 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.817 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 1.5 t -63.38 -15.71 58.31 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -167.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.676 ' HA ' HG22 ' A' ' 984' ' ' ILE . 81.3 t60 -49.38 -21.03 0.78 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -71.29 -53.59 13.74 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.019 -0.673 . . . . 0.0 110.732 176.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.095 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -76.75 -42.69 40.1 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.676 HG22 ' HA ' ' A' ' 981' ' ' HIS . 11.3 tp -59.38 -28.54 39.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.892 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -73.53 -40.95 63.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.533 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.4 ptp -64.87 -57.48 8.72 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.055 -172.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.16 -42.04 27.08 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -174.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.974 ' HA ' HD12 ' A' ' 991' ' ' LEU . 41.6 tt0 -57.35 -42.91 82.92 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.213 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -68.62 -31.02 69.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.366 0.603 . . . . 0.0 109.512 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.793 ' HG ' ' CG ' ' A' 1031 ' ' ASP . 3.1 tp -75.42 -31.81 60.5 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.673 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.974 HD12 ' HA ' ' A' ' 988' ' ' GLN . 44.1 mt -64.71 -49.79 69.49 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.229 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -58.24 -40.39 81.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.535 -177.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 20.2 m -76.98 -35.33 57.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.465 -176.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.96 -31.48 12.15 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.052 ' HA ' HD22 ' A' 1028 ' ' LEU . 1.8 tm? -56.43 -37.64 70.5 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 162.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.564 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -60.42 -48.01 83.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.89 176.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.479 ' O ' ' HD3' ' A' 1001 ' ' LYS . 18.5 mt-10 -59.47 -37.09 77.31 Favored 'General case' 0 CA--C 1.504 -0.797 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.712 176.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.691 ' HG ' HG13 ' A' ' 955' ' ' VAL . 24.2 tp -68.63 -33.42 73.98 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.658 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.594 ' O ' ' HG2' ' A' 1002 ' ' MET . 33.8 pt -79.26 -25.24 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.911 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.516 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.4 m-80 -79.73 -17.06 54.43 Favored 'General case' 0 C--O 1.211 -0.968 0 O-C-N 122.219 -0.3 . . . . 0.0 110.349 167.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.69 ' CG ' ' HA ' ' A' 1021 ' ' MET . 0.3 OUTLIER -86.49 -31.71 21.17 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.619 178.342 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.0 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -69.18 -36.28 77.17 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 167.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.776 ' O ' ' HB2' ' A' 1007 ' ' GLN . 59.9 tttp -62.44 -56.14 20.99 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.921 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' 1000 ' ' ASN . 29.1 mt -58.88 -43.86 91.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.33 -46.78 85.56 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.134 0.492 . . . . 0.0 110.23 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.24 -19.2 56.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.16 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.776 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -76.21 -44.82 36.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.453 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.52 ' O ' ' HG3' ' A' 1010 ' ' MET . 0.0 OUTLIER -71.77 -61.49 1.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.702 176.311 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.551 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 14.2 p 35.39 59.23 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.107 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.675 ' H ' ' HB2' ' A' 1014 ' ' GLN . 67.5 mtt -122.53 42.64 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.897 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' 1014 ' ' GLN . 10.4 m 56.66 -94.6 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 176.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.9 m -82.4 -31.02 29.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' 1010 ' ' MET . 99.4 mt -72.14 -27.08 62.37 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.675 ' HB2' ' H ' ' A' 1010 ' ' MET . 0.7 OUTLIER -64.49 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.813 177.452 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -54.98 -43.76 73.81 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.2 tt0 -50.27 -43.82 53.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.443 174.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.422 ' CE2' HD22 ' A' 1004 ' ' LEU . 2.1 m-30 -77.97 -23.4 48.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.547 0.213 . . . . 0.0 110.681 -179.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' 1022 ' ' LEU . 39.3 ttpt -65.76 -37.0 85.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -71.29 -48.97 47.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.2 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' 1016 ' ' GLU . 70.7 mm-40 -52.13 -37.45 54.37 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 110.564 172.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.69 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 51.8 ttp -63.52 -50.21 70.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.75 176.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' 1018 ' ' LYS . 98.0 mt -61.9 -28.78 69.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.866 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 37.8 m -66.44 -36.73 83.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.489 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.57 -40.03 35.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.577 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.7 80.05 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.237 176.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' 1030 ' ' VAL . 13.9 t60 -54.79 -51.59 65.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.441 176.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.632 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.052 HD22 ' HA ' ' A' ' 995' ' ' LEU . 12.3 tp -73.39 -42.6 61.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.218 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.25 84.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' 1026 ' ' HIS . 54.7 t -67.03 -42.02 88.01 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.335 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.793 ' CG ' ' HG ' ' A' ' 990' ' ' LEU . 25.4 t0 -66.04 -32.29 73.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 176.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.12 -44.97 71.78 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 167.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.688 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 41.6 mtpt -70.84 -23.08 62.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.932 174.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.558 ' O ' HG23 ' A' 1038 ' ' VAL . 48.9 t30 -74.0 -43.79 56.8 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tp -79.85 -21.51 44.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.136 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.828 ' HA ' HG11 ' A' ' 929' ' ' VAL . 2.7 pp -72.08 -22.03 61.42 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.3 t70 -81.15 -48.08 12.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.506 168.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.095 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.4 t -47.89 -61.69 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.444 176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.712 HG12 ' HB ' ' A' ' 925' ' ' VAL . 8.7 tt -89.75 -25.47 5.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 CA-C-N 114.351 -1.295 . . . . 0.0 112.061 -167.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.855 ' O ' ' HG3' ' A' 1043 ' ' ARG . 18.5 t70 -63.34 -33.36 75.35 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 118.983 -1.087 . . . . 0.0 109.032 162.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' 1037 ' ' ASP . 60.6 mt-30 -76.61 -26.86 55.42 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 118.735 -1.186 . . . . 0.0 109.149 171.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.659 ' HA ' ' HB2' ' A' 1045 ' ' LYS . . . -55.01 -50.31 69.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 117.913 0.324 . . . . 0.0 110.581 171.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.855 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -53.39 -41.33 65.81 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.815 178.671 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.622 ' N ' ' HD2' ' A' 1043 ' ' ARG . 31.8 tp -79.85 -29.82 40.17 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 122.006 -0.434 . . . . 0.0 111.395 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.817 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 7.6 mptt -55.05 -46.39 75.35 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.811 0.844 . . . . 0.0 110.173 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 24.8 ttt -62.23 -45.01 95.26 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.715 178.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.467 ' CD1' ' HB2' ' A' ' 920' ' ' ARG . 1.7 mp -67.99 -21.48 26.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.573 176.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' 1045 ' ' LYS . 32.5 t -66.63 -36.85 83.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 0.0 110.422 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -77.36 -34.68 55.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.225 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 32.5 t -88.78 -19.81 25.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.202 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 26.5 mtp180 68.48 152.95 0.13 Allowed Pre-proline 0 N--CA 1.466 0.344 0 C-N-CA 123.555 0.742 . . . . 0.0 111.932 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -72.93 -62.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.747 1.631 . . . . 0.0 109.879 165.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 11.4 p80 . . . . . 0 C--O 1.245 0.835 0 CA-C-N 115.087 -0.961 . . . . 0.0 108.748 170.162 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 1.134 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 120.729 0.3 . . . . 0.0 111.675 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.0 t -113.18 31.54 6.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.175 -175.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.472 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER 51.16 56.38 8.06 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.125 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.3 m-20 -47.26 -173.17 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.101 2.125 . . . . 0.0 112.932 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.8 tmtm? -40.27 -17.38 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.453 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.727 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -63.63 -53.23 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.767 174.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -77.55 -29.92 52.46 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 46.5 mt-10 -61.07 -60.73 3.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.278 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -41.74 82.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.247 -171.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.911 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.1 p -60.09 -37.8 74.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.255 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.423 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 28.1 m -68.59 -31.17 70.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.099 0.476 . . . . 0.0 110.069 173.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.56 -32.21 68.54 Favored Glycine 0 CA--C 1.521 0.463 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.149 172.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.988 HD12 ' HB2' ' A' 1032 ' ' ALA . 3.4 tm? -61.54 -45.48 93.98 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.3 t -58.86 -42.71 86.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.209 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.512 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.0 mmtp -67.14 -21.61 65.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.365 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.16 -31.61 44.05 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.757 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 936' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.98 -13.91 11.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 119.679 -0.809 . . . . 0.0 109.04 172.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 933' ' ' VAL . 45.9 mm -68.21 -43.04 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 164.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 6.4 mm-40 -54.05 -45.17 71.58 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.298 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.805 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.0 tmt? -57.59 -42.18 82.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.251 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 24.2 m -69.04 -30.51 68.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.104 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.599 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 16.7 m -78.33 -43.14 28.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.3 mmtp -56.16 -42.08 76.46 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 113.335 -1.757 . . . . 0.0 111.759 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.747 HD11 ' HE2' ' A' 1018 ' ' LYS . 13.9 tt -73.82 -23.26 18.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.05 -177.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 34.4 mm-40 -53.67 -62.75 3.26 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.2 Cg_endo -99.95 -4.0 0.61 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.545 1.496 . . . . 0.0 114.515 -175.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.638 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -114.15 150.19 43.22 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -170.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 3.4 Cg_exo -82.84 -178.56 3.95 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.223 3.282 . . . . 0.0 112.961 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.725 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 85.7 Cg_exo -50.03 -33.16 33.65 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 123.624 2.883 . . . . 0.0 114.269 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.62 -29.74 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.493 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.638 ' HG3' ' HB1' ' A' ' 946' ' ' ALA . 63.9 mm-40 -97.45 -4.95 37.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.108 177.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.725 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -56.34 -40.79 75.03 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 172.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.03 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.5 OUTLIER -77.13 -48.57 2.51 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.786 176.162 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.2 Cg_exo -52.56 -27.62 33.39 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 121.702 1.601 . . . . 0.0 114.6 172.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.805 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 19.9 ptp -74.2 -34.86 63.86 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.435 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -65.98 -26.76 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.745 171.665 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.717 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.2 tttm -53.24 -44.18 67.91 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 173.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.451 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 2.9 mm-40 -55.49 -47.67 75.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.818 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.477 HG21 HD23 ' A' ' 998' ' ' LEU . 5.0 m -75.31 -30.77 23.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.33 -45.29 31.01 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.873 -174.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.65 -27.3 68.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.81 0.338 . . . . 0.0 110.341 172.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.59 -52.78 62.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.673 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.6 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 2.8 tm? -66.53 -31.24 71.84 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.559 0.618 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.556 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 50.6 ttm-85 -64.61 -48.07 76.27 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 121.784 -0.572 . . . . 0.0 111.074 173.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 39.7 m -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.262 0.553 . . . . 0.0 110.11 171.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.552 HD11 ' HA ' ' A' ' 929' ' ' VAL . 0.5 OUTLIER -61.3 -39.42 90.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.668 176.719 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 52.4 tp -52.21 -32.9 38.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.646 174.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.72 98.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.435 0.636 . . . . 0.0 109.783 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.727 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.7 m -62.38 -38.66 90.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.241 172.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.683 HG13 HD11 ' A' ' 984' ' ' ILE . 93.6 t -54.05 -29.57 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.028 173.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 17.7 t70 -75.92 -25.59 56.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.798 -0.183 . . . . 0.0 111.041 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -66.92 -51.97 48.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.39 1.09 . . . . 0.0 109.163 171.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.407 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 33.3 p -63.7 -22.48 66.93 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.918 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.586 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 22.1 tp -54.45 -57.21 19.72 Favored Pre-proline 0 CA--C 1.54 0.579 0 CA-C-O 118.697 -0.668 . . . . 0.0 112.221 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 20.4 Cg_endo -64.16 -20.64 67.42 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.136 1.442 . . . . 0.0 111.167 173.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 1042 ' ' ALA . 54.5 t -75.17 -18.81 16.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.116 175.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.736 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.9 pp -74.89 -44.36 4.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.882 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.736 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 21.7 Cg_endo -64.3 -26.95 63.71 Favored 'Trans proline' 0 C--N 1.364 1.353 0 CA-C-N 121.145 1.445 . . . . 0.0 110.64 172.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.37 -59.84 3.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.593 172.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.596 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 75.2 m -160.82 -49.01 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.716 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 2.0 t -56.59 -14.35 3.11 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -166.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.603 ' HA ' HG22 ' A' ' 984' ' ' ILE . 20.8 p-80 -51.26 -22.88 3.01 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -170.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.49 ' HA ' ' NE ' ' A' ' 982' ' ' ARG . 4.1 tpm_? -78.69 -51.18 10.19 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 110.026 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.867 ' HG3' HG22 ' A' 1038 ' ' VAL . 2.7 tp10 -73.34 -42.77 61.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.964 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.683 HD11 HG13 ' A' ' 969' ' ' VAL . 0.1 OUTLIER -55.79 -40.18 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -173.563 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -73.37 -31.18 63.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.792 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptp -63.89 -49.13 73.93 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.876 -178.13 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.18 -39.12 34.17 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 116.876 -0.147 . . . . 0.0 111.174 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 1.094 ' HA ' HD12 ' A' ' 991' ' ' LEU . 5.5 tp60 -58.11 -47.6 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.799 -178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -60.83 -35.83 77.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.543 0.687 . . . . 0.0 109.47 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.449 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.4 OUTLIER -68.25 -45.0 74.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.757 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.094 HD12 ' HA ' ' A' ' 988' ' ' GLN . 3.8 mt -58.76 -55.8 30.39 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.546 0.689 . . . . 0.0 110.507 -177.143 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -59.93 -33.1 71.45 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.821 -171.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 12.2 p -74.55 -38.49 62.72 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.679 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 51.3 m-20 -103.17 -28.63 11.81 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.087 -172.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.9 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.56 -42.83 93.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.217 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.613 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -64.15 -44.35 92.39 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.926 175.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.626 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 38.2 tt0 -53.41 -46.55 69.79 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.492 176.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' 1002 ' ' MET . 28.2 tp -67.08 -38.55 85.95 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.898 -173.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.752 ' HA ' HG21 ' A' ' 955' ' ' VAL . 32.1 pt -61.05 -31.56 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.541 -178.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.624 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -95.32 -12.48 26.04 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.195 178.358 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.626 ' HG3' ' HG2' ' A' ' 997' ' ' GLU . 4.7 mmmm -84.74 -33.88 22.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.799 0.333 . . . . 0.0 110.453 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.698 ' SD ' ' HG3' ' A' 1021 ' ' MET . 72.7 mmm -74.4 -44.54 51.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 174.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 47.1 tttp -53.47 -44.27 68.83 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.872 167.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.717 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 18.1 tp -58.71 -49.02 79.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 175.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.687 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -59.12 -40.28 84.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.561 0.696 . . . . 0.0 109.671 175.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.616 ' HG3' HG12 ' A' ' 952' ' ' VAL . 1.1 tm0? -64.49 -33.3 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.733 173.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.4 tp60 -77.31 -24.36 50.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.123 -174.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.694 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.4 t80 -81.45 -64.28 1.22 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.603 174.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.573 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 8.0 p 37.13 40.63 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 O-C-N 124.695 1.247 . . . . 0.0 112.044 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.499 ' SD ' HD23 ' A' 1013 ' ' LEU . 53.7 ttm -80.89 9.06 6.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.83 -175.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' 1012 ' ' SER . 40.5 p 55.7 120.54 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.398 1.079 . . . . 0.0 112.839 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' 1011 ' ' THR . 51.4 m 73.39 -59.06 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.787 -177.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.499 HD23 ' SD ' ' A' 1010 ' ' MET . 29.2 tp -73.49 -7.79 53.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.455 0.645 . . . . 0.0 110.178 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.573 ' HG3' ' HA ' ' A' 1009 ' ' VAL . 1.1 tm0? -71.99 -17.4 62.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.51 0.672 . . . . 0.0 110.03 175.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' 1018 ' ' LYS . 12.1 tp60 -61.01 -38.47 86.2 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.528 -173.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' 1013 ' ' LEU . 6.6 pt-20 -58.53 -36.15 73.42 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.401 -0.52 . . . . 0.0 111.406 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 0.7 OUTLIER -70.22 -23.36 62.92 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.416 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.747 ' HE2' HD11 ' A' ' 943' ' ' ILE . 64.6 tttm -80.33 -25.05 39.49 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.564 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -74.71 -54.14 7.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -53.1 -32.15 45.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.657 170.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.698 ' HG3' ' SD ' ' A' 1002 ' ' MET . 33.1 ttp -57.02 -49.0 77.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.591 175.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -64.02 -49.92 70.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -60.08 -37.57 80.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.147 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -73.78 -40.07 63.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.478 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.28 -34.85 79.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.614 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.56 ' O ' HG23 ' A' 1030 ' ' VAL . 76.4 t60 -74.28 -38.6 63.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.52 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.62 83.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 173.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.9 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -56.56 -46.04 80.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.007 176.233 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' 1033 ' ' LYS . . . -55.67 -30.85 61.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.478 176.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 1026 ' ' HIS . 57.7 t -71.94 -33.0 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.679 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 1.1 m-20 -51.77 -47.71 64.05 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.505 0.669 . . . . 0.0 109.3 172.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.988 ' HB2' HD12 ' A' ' 932' ' ' LEU . . . -66.46 -48.55 69.55 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.76 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.601 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 89.1 mttt -60.6 -39.67 88.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.716 -174.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' 1038 ' ' VAL . 65.5 t30 -71.26 -36.95 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.034 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.773 HD22 HD11 ' A' ' 991' ' ' LEU . 20.4 tp -77.84 -29.4 50.5 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.544 -177.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.911 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -68.35 -24.86 64.86 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' 1041 ' ' GLN . 38.6 t70 -81.8 -45.47 15.54 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.864 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.867 HG22 ' HG3' ' A' ' 983' ' ' GLU . 24.5 t -53.89 -62.16 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.806 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.77 HG12 ' O ' ' A' 1035 ' ' LEU . 8.2 pt -84.0 -27.46 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -173.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.612 ' O ' ' HG3' ' A' 1043 ' ' ARG . 26.5 t70 -61.06 -30.8 70.54 Favored 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 118.145 -1.422 . . . . 0.0 108.893 163.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.547 ' O ' ' HD3' ' A' 1045 ' ' LYS . 73.6 mt-30 -79.76 -24.04 41.81 Favored 'General case' 0 C--O 1.203 -1.394 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.677 169.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -58.22 -52.63 64.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.331 0.586 . . . . 0.0 109.822 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1043 ' ' ARG . . . . . 1.134 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 6.5 ppt_? -57.3 -32.09 66.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.677 176.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' 1043 ' ' ARG . 51.7 tp -78.95 -29.68 44.16 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.177 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.716 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 12.0 mptt -61.52 -43.23 99.23 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.684 0.793 . . . . 0.0 110.167 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.1 ttt -64.33 -35.03 79.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.567 176.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' 1051 ' ' ARG . 45.6 mm -70.72 -43.54 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.914 174.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.5 m -51.74 -33.01 32.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.014 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.418 ' OE1' ' HA ' ' A' 1049 ' ' GLN . 6.8 tp60 -83.46 -29.65 27.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.682 0.277 . . . . 0.0 111.042 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 3.1 p -88.15 -10.83 48.69 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' 1047 ' ' ILE . 13.2 ptm180 -133.29 104.74 12.3 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 121.188 0.518 . . . . 0.0 110.191 173.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -67.05 -16.66 49.9 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 123.107 2.538 . . . . 0.0 112.686 -178.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 10.1 p80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.974 178.887 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 25.0 tpt180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 63.9 m 68.92 -1.71 1.97 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.563 0.697 . . . . 0.0 110.626 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.885 ' OD1' ' HA ' ' A' 1040 ' ' ASP . 0.4 OUTLIER 64.77 74.66 0.39 Allowed 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 114.364 -1.289 . . . . 0.0 113.952 174.436 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.558 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.1 t70 -48.88 -173.77 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 111.907 -2.406 . . . . 0.0 113.277 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.662 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.0 tmtp? -41.08 -14.52 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.617 1.167 . . . . 0.0 112.88 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.768 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.5 m -63.6 -51.58 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 C-N-CA 122.959 0.503 . . . . 0.0 112.042 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.772 ' HB2' ' OD1' ' A' ' 922' ' ' ASN . 49.0 t80 -75.49 -34.12 60.85 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.257 1.027 . . . . 0.0 108.384 -178.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.625 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 40.5 mt-10 -64.94 -58.7 5.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 113.475 -1.693 . . . . 0.0 112.59 -176.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.662 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 3.6 t-20 -73.36 -31.02 63.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -171.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.735 ' CG2' HD11 ' A' 1039 ' ' ILE . 22.7 t -68.28 -35.86 72.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.793 176.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.48 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 90.5 m -56.86 -25.31 56.29 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.553 0.692 . . . . 0.0 109.969 163.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 931' ' ' GLY . . . . . 0.477 ' HA2' ' HG2' ' A' ' 934' ' ' LYS . . . -71.84 -26.88 71.76 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.526 176.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.729 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.4 tt -61.93 -41.35 97.84 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 172.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.65 ' O ' HG12 ' A' ' 937' ' ' ILE . 45.0 t -61.06 -45.2 99.03 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.979 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.499 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.3 mmpt? -54.67 -44.49 73.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.551 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.708 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.01 -28.65 60.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.7 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.8 p -77.62 -18.38 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 119.869 -0.732 . . . . 0.0 109.629 174.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 933' ' ' VAL . 34.8 mm -67.95 -26.08 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 169.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 35.5 mm-40 -64.9 -42.47 94.74 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.322 173.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.724 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.6 ptt? -55.64 -42.14 74.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.331 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 9.7 p -75.07 -35.22 61.85 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 12.1 p -77.6 -48.95 15.63 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.264 0.554 . . . . 0.0 111.067 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.465 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -68.64 -22.19 64.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.386 -176.169 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.69 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 10.4 tp -79.89 -22.75 11.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.669 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.709 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 33.7 mm-40 -49.3 -54.97 24.44 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.826 -0.17 . . . . 0.0 110.96 175.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 76.2 Cg_endo -95.24 30.22 0.21 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.614 1.543 . . . . 0.0 113.2 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.934 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -133.11 153.26 80.76 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -173.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.631 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.9 Cg_endo -92.88 -175.23 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.025 3.15 . . . . 0.0 111.968 174.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.911 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 9.7 Cg_endo -53.17 -30.53 51.01 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.875 2.384 . . . . 0.0 112.836 176.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.404 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 32.2 mm-40 -57.66 -29.52 64.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.061 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.934 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 48.9 mm-40 -102.02 0.86 35.76 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.088 0.243 . . . . 0.0 111.198 175.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.911 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 1.7 m-85 -59.26 -44.03 92.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.023 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -74.78 -48.09 4.93 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.392 176.144 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.023 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.7 Cg_exo -55.77 -23.63 42.56 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 121.696 1.598 . . . . 0.0 114.596 172.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.751 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 22.2 ptt? -73.32 -36.44 66.23 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.114 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 1.035 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -66.63 -27.22 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.085 172.763 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 83.1 tttt -55.15 -42.1 72.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 175.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.86 -47.44 71.0 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.462 173.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.623 HG12 ' HA ' ' A' ' 936' ' ' VAL . 0.9 OUTLIER -68.47 -23.59 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.223 176.611 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.568 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -66.26 -42.69 94.01 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 963' ' ' ARG . 84.5 mt -70.27 -10.27 58.43 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.27 0.557 . . . . 0.0 110.362 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -78.83 -56.24 4.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.925 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.717 HD12 ' HB3' ' A' ' 991' ' ' LEU . 2.6 tt -66.67 -29.06 68.99 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.285 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.504 ' HD2' HD23 ' A' ' 960' ' ' LEU . 54.9 mtt-85 -59.56 -61.42 2.63 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.069 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 5.3 m -56.1 -30.66 62.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.059 0.457 . . . . 0.0 110.95 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.727 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -67.12 -41.43 86.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.912 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -52.91 -35.48 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.377 174.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -60.91 -49.4 77.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.142 0.496 . . . . 0.0 110.068 175.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.2 m -58.24 -42.86 87.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.775 171.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.716 HG13 HD11 ' A' ' 984' ' ' ILE . 53.3 t -54.42 -30.96 22.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.422 0.153 . . . . 0.0 111.168 174.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.632 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 19.3 t70 -71.62 -26.09 62.43 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 177.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 975' ' ' VAL . 39.1 mm-40 -69.09 -44.89 71.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.383 1.087 . . . . 0.0 108.889 169.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.604 ' OG ' HG21 ' A' ' 980' ' ' THR . 33.4 t -66.36 -24.56 66.52 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.857 178.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.704 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.5 OUTLIER -60.71 -52.98 68.73 Favored Pre-proline 0 C--O 1.214 -0.783 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.639 -177.264 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.632 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.5 Cg_endo -58.71 -26.82 81.29 Favored 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.676 1.634 . . . . 0.0 111.373 170.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.567 HG13 ' HB2' ' A' 1046 ' ' MET . 2.1 t -75.82 -15.9 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.527 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 1.039 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -64.53 -52.68 50.73 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.695 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.669 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 31.5 Cg_exo -62.71 -30.26 78.25 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 121.409 1.406 . . . . 0.0 111.084 175.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.27 -57.33 10.8 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.173 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.824 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 17.1 m -165.49 -36.36 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.242 0.544 . . . . 0.0 112.194 -174.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.792 HG22 ' HB ' ' A' ' 984' ' ' ILE . 70.7 m -56.18 -22.71 30.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -173.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 1.039 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 24.7 p-80 -51.05 -30.02 14.45 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.054 0.843 . . . . 0.0 112.808 -172.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 40.3 mtm105 -62.28 -55.39 28.7 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.927 -0.709 . . . . 0.0 111.532 173.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.758 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.47 -47.29 23.44 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.471 -0.491 . . . . 0.0 112.198 -174.786 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.792 ' HB ' HG22 ' A' ' 980' ' ' THR . 13.0 tt -55.27 -37.97 45.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.429 -172.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 2.9 pp20? -73.28 -31.7 64.22 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.181 -178.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.741 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 18.0 ptp -62.54 -56.76 14.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.218 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.707 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.11 -33.16 44.62 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.802 ' HA ' HD12 ' A' ' 991' ' ' LEU . 57.7 tt0 -60.43 -44.69 95.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.306 -178.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.565 ' HG3' ' O ' ' A' ' 985' ' ' GLU . 28.0 mtmm -64.73 -34.04 77.39 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.555 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 3.0 tp -64.12 -46.31 84.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.495 177.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.042 HD11 ' HG ' ' A' 1035 ' ' LEU . 13.2 mt -54.51 -60.14 3.76 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.075 0.464 . . . . 0.0 110.568 175.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -50.99 -43.03 60.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.241 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.558 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 42.0 t -62.35 -56.94 13.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.957 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.46 ' O ' HD23 ' A' ' 998' ' ' LEU . 1.8 m-20 -83.15 -42.89 16.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -168.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.925 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.8 OUTLIER -53.1 -55.1 26.55 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.812 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.701 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -54.75 -43.82 73.04 Favored 'General case' 0 N--CA 1.46 0.067 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 174.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.735 ' O ' ' HG2' ' A' 1001 ' ' LYS . 36.5 mt-10 -54.24 -43.29 70.77 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.241 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.719 ' O ' ' HG2' ' A' 1002 ' ' MET . 4.1 mm? -63.64 -36.47 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.049 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.88 ' HA ' HG11 ' A' ' 955' ' ' VAL . 11.1 pt -71.04 -7.87 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 119.99 -0.684 . . . . 0.0 109.972 -177.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 13.7 m-80 -113.13 -15.3 12.8 Favored 'General case' 0 C--O 1.207 -1.145 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.735 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 21.8 mmmt -73.75 -32.73 63.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.035 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 12.3 mmt -78.55 -42.02 30.46 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.7 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 16.1 tppt? -55.4 -45.18 76.66 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.206 169.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' 1004 ' ' LEU . 14.6 mt -61.51 -48.21 82.1 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.687 0.617 . . . . 0.0 112.286 175.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.78 -44.1 86.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.169 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.63 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.2 pp0? -76.48 -16.56 59.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.841 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.684 ' HB2' ' O ' ' A' 1003 ' ' LYS . 43.9 tp60 -81.42 -36.72 29.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.315 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.586 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.2 t80 -73.05 -66.44 0.68 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.332 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 9.4 p 38.76 37.18 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 124.663 1.227 . . . . 0.0 112.129 178.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 24.0 ttt -90.4 106.34 18.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.503 -174.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 46.7 p 44.47 -95.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 O-C-N 124.339 1.025 . . . . 0.0 112.758 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 50.5 m -135.68 9.86 3.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.413 0.625 . . . . 0.0 109.967 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.12 -5.53 59.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.02 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -27.15 62.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.618 177.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.96 -31.6 65.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' 1020 ' ' GLN . 34.8 tt0 -54.46 -54.31 42.63 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.849 170.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.586 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-85 -60.21 -35.88 76.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.007 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -62.12 -36.34 81.48 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.597 0.237 . . . . 0.0 110.974 171.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' 1016 ' ' GLU . 14.5 tppt? -63.28 -54.9 30.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.041 0.448 . . . . 0.0 110.063 175.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' 1016 ' ' GLU . 6.8 mm-40 -51.3 -37.77 49.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.212 173.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1021 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -65.69 -41.8 91.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.122 177.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 69.8 mt -60.5 -44.25 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 111.408 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.8 m -66.04 -46.7 76.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.232 0.539 . . . . 0.0 110.229 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.639 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -62.28 -43.41 98.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.191 178.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.486 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -60.39 -31.57 70.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.775 0.321 . . . . 0.0 111.009 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' 1030 ' ' VAL . 12.2 t-80 -75.76 -35.69 60.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.575 -0.45 . . . . 0.0 109.847 176.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.39 94.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.925 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.8 tt -56.29 -55.82 28.58 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.605 0.717 . . . . 0.0 111.004 171.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -52.98 -28.79 25.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.005 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' 1026 ' ' HIS . 77.4 t -74.11 -41.64 51.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 119.619 -0.229 . . . . 0.0 111.519 173.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.747 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -61.53 -46.93 87.85 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.09 177.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -53.77 -40.46 66.25 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.79 169.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 88.6 tttt -77.37 -35.04 54.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.424 0.631 . . . . 0.0 110.246 -172.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.453 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -75.41 -45.57 38.1 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.988 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1035 ' ' LEU . . . . . 1.042 ' HG ' HD11 ' A' ' 991' ' ' LEU . 3.4 tm? -67.99 -33.68 75.09 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.96 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' 1040 ' ' ASP . 4.2 pp -64.74 -29.34 70.32 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.48 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 20.8 t70 -84.98 -37.67 20.17 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.887 0.742 . . . . 0.0 109.511 178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.758 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 5.7 t -52.88 -52.97 23.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.654 172.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.808 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 24.4 pt -90.48 -22.77 6.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.885 ' HA ' ' OD1' ' A' ' 922' ' ' ASN . 6.2 t70 -44.81 -49.26 10.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 157.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 76.7 mt-30 -78.44 -27.33 46.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.481 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.808 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.68 -56.12 22.53 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 118.333 0.515 . . . . 0.0 111.46 175.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.608 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.1 OUTLIER -57.82 -32.3 67.45 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.336 176.49 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.87 -13.1 59.99 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.762 174.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.7 mmtp -73.24 -35.47 66.26 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 59.8 ttm -66.42 -40.65 89.66 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.669 173.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.03 -35.0 62.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.794 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 22.3 t -70.12 -33.87 72.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.02 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -78.46 -31.49 47.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.743 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 49.4 m -81.71 -34.09 30.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.356 175.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 73.02 133.39 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.347 0 C-N-CA 123.823 0.849 . . . . 0.0 111.392 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.38 147.23 86.39 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.976 2.45 . . . . 0.0 112.332 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 13.7 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.226 -178.571 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.678 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 2.1 tpm_? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 35.2 t 73.53 -0.24 3.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.035 0.534 . . . . 0.0 111.668 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.4 OUTLIER 52.54 68.75 0.78 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-O 121.598 0.714 . . . . 0.0 111.247 175.12 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 925' ' ' VAL . 45.3 t0 -45.1 -171.78 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 112.105 -2.316 . . . . 0.0 112.687 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.688 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.3 tmtp? -34.9 -21.44 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.392 1.077 . . . . 0.0 113.007 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.817 HG21 ' HB2' ' A' 1043 ' ' ARG . 0.5 OUTLIER -56.36 -56.17 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 172.942 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -78.02 -30.54 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.156 0.979 . . . . 0.0 108.527 -177.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 86.4 mt-10 -60.31 -50.92 71.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.978 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.493 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 32.3 t-20 -66.1 -44.46 84.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.346 -174.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' 1036 ' ' LEU . 4.1 t -62.44 -30.97 50.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.057 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.539 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 56.4 m -64.05 -34.77 78.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.881 0.848 . . . . 0.0 109.146 171.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.95 -28.0 62.94 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.85 172.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.998 HD12 HD13 ' A' ' 965' ' ' LEU . 3.7 tt -66.92 -49.17 66.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 117.455 0.627 . . . . 0.0 109.745 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 937' ' ' ILE . 3.4 m -63.01 -32.24 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.895 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.539 ' HD2' ' O ' ' A' ' 930' ' ' THR . 1.3 mpmm? -65.07 -28.41 69.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.854 0.359 . . . . 0.0 110.994 174.257 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.664 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.14 -26.03 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 0.0 111.265 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.574 ' HA ' HG12 ' A' ' 958' ' ' VAL . 9.7 p -80.81 -10.43 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.124 172.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.7 mm -71.86 -36.87 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 166.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 41.2 mt-10 -57.74 -45.05 86.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.668 170.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.58 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.2 -45.2 91.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.682 176.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.732 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.9 t -64.27 -37.98 89.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.308 -177.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.573 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.5 p -77.11 -38.87 51.3 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 -176.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.646 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.7 mmtp -52.87 -49.96 64.79 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.683 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.738 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.2 tt -71.1 -23.74 23.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.811 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 84.7 mm-40 -59.38 -64.75 2.6 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -175.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.811 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -101.29 5.55 0.59 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.667 1.578 . . . . 0.0 113.832 -174.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -110.62 157.22 38.98 Favored Pre-proline 0 C--N 1.323 -0.572 0 C-N-CA 120.627 -0.429 . . . . 0.0 112.098 -173.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.99 176.37 9.46 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.417 2.744 . . . . 0.0 112.237 177.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.719 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 77.7 Cg_exo -53.29 -24.93 28.72 Favored 'Trans proline' 0 C--O 1.245 0.863 0 C-N-CA 123.318 2.679 . . . . 0.0 113.289 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -54.55 -31.27 56.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.097 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.553 ' OE1' ' HE2' ' A' ' 942' ' ' LYS . 10.7 mm-40 -100.96 1.18 39.48 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.323 178.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.719 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 13.7 m-30 -64.27 -39.01 93.07 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 172.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.037 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -73.18 -51.22 6.08 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.591 174.856 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.007 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.3 Cg_exo -51.62 -36.86 62.24 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.157 1.905 . . . . 0.0 114.742 172.267 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.738 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 26.4 ptt? -62.71 -46.99 85.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.394 0.616 . . . . 0.0 110.054 -177.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.586 ' O ' HG22 ' A' ' 958' ' ' VAL . 89.4 t -68.21 -26.55 34.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 173.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 87.3 tttt -58.75 -38.11 77.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 6.1 mm-40 -55.37 -46.88 76.45 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.855 174.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.5 m -74.24 -22.35 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 O-C-N 122.202 -0.311 . . . . 0.0 111.829 177.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.566 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.48 -44.0 66.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.135 -1.031 . . . . 0.0 111.479 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.3 mm? -64.42 -27.78 69.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.588 0.232 . . . . 0.0 110.768 171.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.686 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.62 -56.91 16.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.218 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 991' ' ' LEU . 5.1 tt -63.03 -36.57 84.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.191 -0.204 . . . . 0.0 111.057 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 46.1 ttt180 -59.85 -53.47 57.51 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 176.021 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.8 m -55.92 -40.9 73.76 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.848 0.832 . . . . 0.0 109.914 174.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.998 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -60.78 -29.51 69.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.851 176.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.436 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.1 tp -68.03 -29.56 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.549 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.33 -38.33 90.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.352 0.596 . . . . 0.0 109.668 173.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.754 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.3 m -71.2 -33.69 70.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.101 174.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 965' ' ' LEU . 78.6 t -55.12 -30.99 24.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.537 171.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.49 ' HA ' ' HB2' ' A' ' 973' ' ' LEU . 24.6 t70 -77.87 -26.23 49.12 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 177.245 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.549 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.5 mm-40 -65.91 -54.25 28.93 Favored 'General case' 0 C--O 1.25 1.079 0 CA-C-O 123.344 1.545 . . . . 0.0 108.514 170.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.439 ' O ' HD13 ' A' ' 976' ' ' LEU . 46.6 t -62.84 -26.94 69.0 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.657 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.761 ' HA ' HD13 ' A' ' 976' ' ' LEU . 4.9 tt -57.33 -52.99 70.09 Favored Pre-proline 0 N--CA 1.472 0.674 0 CA-C-O 118.597 -0.716 . . . . 0.0 112.421 -174.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 51.7 Cg_exo -55.19 -30.75 72.82 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.178 1.456 . . . . 0.0 110.541 170.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 2.6 t -77.05 -13.71 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.618 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.878 ' HG ' HG21 ' A' ' 984' ' ' ILE . 5.8 mp -61.72 -64.45 3.07 Favored Pre-proline 0 N--CA 1.472 0.66 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.8 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.741 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 17.3 Cg_endo -58.21 -28.19 83.24 Favored 'Trans proline' 0 C--N 1.364 1.361 0 C-N-CA 121.505 1.47 . . . . 0.0 111.291 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.629 ' O ' ' HG3' ' A' 1049 ' ' GLN . . . -59.52 -52.2 66.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.513 173.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 979' ' ' SER . . . . . 1.052 ' HB3' ' HB3' ' A' 1045 ' ' LYS . 3.5 t -171.58 -33.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.034 0.445 . . . . 0.0 112.044 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.985 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.0 m -63.81 -22.19 66.79 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -172.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.448 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.8 t-80 -53.21 -21.56 5.38 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -175.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -76.1 -54.78 6.33 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.162 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.762 ' CG ' HG22 ' A' 1038 ' ' VAL . 3.4 tp10 -74.49 -43.14 57.35 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.426 -0.509 . . . . 0.0 111.374 -178.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.985 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.2 OUTLIER -59.45 -37.71 71.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -174.527 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.27 -43.88 83.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.543 174.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.696 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.8 ptm -63.02 -47.91 81.04 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.143 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.791 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -79.44 -43.54 23.09 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.839 ' HA ' HD12 ' A' ' 991' ' ' LEU . 61.5 tt0 -60.27 -45.98 91.42 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.974 -0.291 . . . . 0.0 111.544 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -66.54 -31.02 71.47 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.413 ' HG ' ' HB2' ' A' 1031 ' ' ASP . 1.8 tp -65.93 -40.39 91.36 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.359 175.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.043 HD11 HD22 ' A' 1035 ' ' LEU . 18.5 mt -58.07 -56.28 24.13 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.519 0.676 . . . . 0.0 110.557 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.99 -31.8 63.36 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.75 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.5 m -76.07 -36.34 59.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.838 -177.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -102.55 -31.47 10.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.06 -174.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.876 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.5 tm? -59.41 -41.25 89.06 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 168.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -63.61 -44.63 93.37 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.152 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.52 ' O ' ' HD3' ' A' 1001 ' ' LYS . 19.2 mm-40 -53.14 -43.33 66.9 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.681 173.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' 1028 ' ' LEU . 2.4 mt -67.26 -28.97 68.47 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.74 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 995' ' ' LEU . 44.0 mm -66.23 -43.21 91.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.837 177.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.589 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.2 m-20 -79.31 -15.2 58.31 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.853 177.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.52 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -87.17 -36.83 17.81 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.204 0.315 . . . . 0.0 111.371 178.464 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.037 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -65.71 -39.48 91.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 169.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 58.9 tttm -62.56 -53.31 56.54 Favored 'General case' 0 C--O 1.204 -1.322 0 CA-C-N 114.021 -1.445 . . . . 0.0 108.511 174.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' 1000 ' ' ASN . 21.5 tp -49.29 -56.38 9.64 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.352 1.061 . . . . 0.0 113.489 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.84 -45.85 89.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.479 0.657 . . . . 0.0 110.18 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.4 pp0? -76.54 -11.06 59.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.086 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -81.27 -40.31 23.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.267 -176.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.545 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 11.7 m-85 -115.68 22.37 13.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.807 177.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.645 HG23 ' HG2' ' A' ' 948' ' ' PRO . 1.5 p -28.93 116.93 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 11.3 tpt 81.34 164.22 0.15 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.779 165.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.3 m 76.41 74.85 0.08 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.305 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 65.1 m 64.25 -70.33 0.08 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 171.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' 1013 ' ' LEU . 3.6 mm? -61.67 -15.59 41.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -169.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.501 ' HA ' ' HD2' ' A' 1017 ' ' TYR . 0.7 OUTLIER -52.93 -44.8 67.29 Favored 'General case' 0 C--O 1.219 -0.525 0 O-C-N 123.05 0.219 . . . . 0.0 110.495 -176.63 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -55.07 -34.83 63.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.555 ' HG2' ' CE1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -48.05 -50.31 28.43 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.825 0.821 . . . . 0.0 110.882 168.423 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.588 ' HB3' ' HG ' ' A' 1004 ' ' LEU . 14.5 m-85 -78.98 -20.06 50.08 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.668 -175.301 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.507 ' O ' ' HG ' ' A' 1022 ' ' LEU . 19.0 ttmm -72.34 -33.13 67.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.211 169.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.416 ' HB3' ' HE3' ' A' 1019 ' ' LYS . 20.6 mmmt -74.42 -56.67 4.59 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.566 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.511 ' HG3' ' O ' ' A' 1016 ' ' GLU . 44.2 mt-30 -50.8 -31.7 17.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.466 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 14.9 tmm? -67.85 -45.95 73.14 Favored 'General case' 0 C--O 1.23 0.06 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.266 175.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' 1018 ' ' LYS . 95.8 mt -60.54 -40.14 90.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.874 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 24.8 m -62.59 -34.17 76.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 0.0 110.582 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.42 -42.04 31.23 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.069 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.504 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -61.83 -38.43 88.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.05 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.6 ' O ' HG23 ' A' 1030 ' ' VAL . 19.0 t-80 -69.08 -47.92 64.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.375 178.087 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.14 -34.94 75.8 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.441 0.463 . . . . 0.0 110.427 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.7 OUTLIER -63.12 -50.05 72.0 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.685 0.755 . . . . 0.0 110.385 174.688 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.56 -37.53 68.13 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.053 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 1026 ' ' HIS . 57.2 t -67.57 -30.57 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.351 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.7 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -75.14 -39.35 60.55 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.711 -0.795 . . . . 0.0 109.029 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.423 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.19 -53.16 59.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.19 172.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.521 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 27.0 mtpp -61.89 -39.73 92.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.814 -177.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.625 ' O ' HG23 ' A' 1038 ' ' VAL . 15.0 t-20 -68.55 -38.01 80.43 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.111 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1035 ' ' LEU . . . . . 1.043 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.36 -26.08 46.56 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.09 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.57 ' HB3' ' HB ' ' A' ' 929' ' ' VAL . 4.4 pp -74.11 -21.57 59.84 Favored 'General case' 0 C--O 1.211 -0.944 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.433 ' O ' ' HG3' ' A' 1041 ' ' GLN . 3.9 m-20 -82.23 -46.53 13.59 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 123.967 0.792 . . . . 0.0 109.163 170.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.791 HG21 ' HB2' ' A' ' 987' ' ' ALA . 29.0 t -50.6 -57.07 2.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.482 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.812 ' CG2' ' HB ' ' A' ' 925' ' ' VAL . 17.2 mt -73.36 -35.97 47.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.95 -177.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' 1036 ' ' LEU . 5.0 t70 -50.98 -45.46 60.96 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 166.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 71.7 mt-30 -72.57 -29.34 63.45 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.09 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' 1045 ' ' LYS . . . -54.03 -58.03 8.82 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 121.043 0.449 . . . . 0.0 111.777 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.817 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.6 OUTLIER -59.51 -28.83 67.41 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.356 177.714 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 40.1 tp -77.42 -25.82 51.1 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.451 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1045 ' ' LYS . . . . . 1.052 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 3.6 mmpm? -63.33 -33.59 75.86 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.855 0.836 . . . . 0.0 109.091 175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.9 ttt -64.72 -43.6 92.91 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.301 -1.318 . . . . 0.0 109.275 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.496 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.1 mm -60.85 -43.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.0 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' 1045 ' ' LYS . 66.3 m -53.97 -29.61 43.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.219 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' ' 978' ' ' ALA . 26.5 mm-40 -108.95 -28.46 9.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -176.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 35.3 t -72.98 -21.82 60.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.842 -0.163 . . . . 0.0 111.116 -177.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' A' 1051 ' ' ARG . 12.2 tpt180 -127.66 108.26 20.67 Favored Pre-proline 0 C--N 1.328 -0.356 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.386 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.39 -39.69 5.06 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.808 2.339 . . . . 0.0 111.195 173.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 26.5 t60 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.532 -0.746 . . . . 0.0 109.67 176.89 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 1.018 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 38.2 m 74.27 22.75 2.17 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.888 0.742 . . . . 0.0 111.034 -174.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 1.018 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 44.02 55.65 5.2 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.999 176.091 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 925' ' ' VAL . 14.0 m-20 -46.52 -175.15 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.487 0 O-C-N 125.121 1.513 . . . . 0.0 112.582 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.556 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 5.4 tmtp? -33.06 -24.76 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.667 1.187 . . . . 0.0 113.243 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.799 HG21 ' HB2' ' A' 1043 ' ' ARG . 4.9 m -61.85 -53.38 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-O 119.194 -0.431 . . . . 0.0 112.081 175.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.601 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 71.2 t80 -78.4 -27.29 46.69 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.546 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.5 mt-10 -64.97 -61.12 2.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.901 -178.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.556 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -70.02 -34.53 73.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.11 -172.726 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.96 ' HB ' HD11 ' A' 1039 ' ' ILE . 12.7 p -62.36 -34.76 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.816 175.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.543 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -68.1 -35.36 78.03 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.94 -28.39 63.46 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.416 172.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.66 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.5 tt -63.39 -42.93 98.83 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 175.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 937' ' ' ILE . 42.4 t -63.97 -38.12 81.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.263 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 934' ' ' LYS . 10.5 mmpt? -65.11 -33.95 77.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.992 0.425 . . . . 0.0 110.469 177.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -76.2 -26.13 55.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.338 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.722 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -83.38 -14.14 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.673 173.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.591 HG12 ' O ' ' A' ' 933' ' ' VAL . 39.7 mm -70.08 -35.79 65.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 166.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.609 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 46.5 mt-10 -54.35 -43.65 71.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.365 170.369 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.641 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.2 ttp -58.46 -43.59 88.93 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.596 0.56 . . . . 0.0 110.356 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.576 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 16.7 m -65.6 -37.18 85.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.093 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.6 m -77.3 -43.06 34.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -177.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.695 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.4 mmtm -49.94 -57.65 7.05 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.601 -1.636 . . . . 0.0 111.259 176.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 12.9 tt -62.5 -29.27 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.786 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.5 mt-30 -50.29 -60.69 4.8 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.786 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 18.1 Cg_endo -93.37 0.94 3.44 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.499 1.466 . . . . 0.0 113.879 177.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.884 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -90.16 148.43 39.3 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.57 175.34 6.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.902 3.068 . . . . 0.0 110.064 165.153 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.677 ' HG3' HG21 ' A' 1009 ' ' VAL . 9.9 Cg_endo -51.87 -31.01 40.94 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.742 2.295 . . . . 0.0 112.511 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.54 -33.27 67.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.081 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.884 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -98.73 -0.27 43.11 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 122.953 0.158 . . . . 0.0 111.297 175.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.726 ' O ' ' HG2' ' A' ' 954' ' ' MET . 10.1 m-30 -65.55 -37.84 87.88 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 175.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.094 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -78.42 -45.16 2.08 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.163 173.447 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.094 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.4 Cg_exo -53.81 -28.43 47.94 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.829 1.686 . . . . 0.0 113.999 170.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 16.6 ptt? -72.87 -37.89 67.21 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.465 178.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.785 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -64.82 -26.49 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.702 171.494 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 55.7 tttt -57.0 -40.77 77.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -55.67 -46.17 77.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.49 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 936' ' ' VAL . 1.6 m -72.77 -22.7 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 120.798 0.332 . . . . 0.0 111.179 176.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.57 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.28 -44.27 66.56 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.175 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.2 mm? -63.78 -24.07 67.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.948 172.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -61.1 -57.82 10.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.324 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.69 ' HB2' HD13 ' A' ' 995' ' ' LEU . 22.8 tp -68.71 -34.42 75.61 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.637 -0.425 . . . . 0.0 112.016 178.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 959' ' ' GLY . 75.1 mtp180 -59.57 -55.23 37.1 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.772 -0.58 . . . . 0.0 112.437 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.44 HG22 ' OD1' ' A' ' 928' ' ' ASN . 14.7 m -57.88 -34.7 70.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.584 0.707 . . . . 0.0 110.242 174.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.674 HD11 HD21 ' A' 1035 ' ' LEU . 3.0 tm? -63.81 -29.0 70.24 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.235 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.476 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 0.2 OUTLIER -66.94 -28.16 68.06 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.687 -178.839 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.06 89.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.381 0.61 . . . . 0.0 109.836 172.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.747 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.3 m -58.55 -39.68 80.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.61 172.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.555 HG13 HD11 ' A' ' 984' ' ' ILE . 72.7 t -54.07 -30.55 20.22 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.307 174.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.2 t70 -74.65 -24.06 58.77 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.59 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.6 mm-40 -71.91 -51.22 23.28 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.83 1.3 . . . . 0.0 109.135 169.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.422 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 30.9 t -65.45 -24.56 67.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.803 -1.544 . . . . 0.0 111.056 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.652 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 28.4 tp -63.76 -50.17 72.61 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-O 118.468 -0.777 . . . . 0.0 112.454 -175.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.613 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.8 Cg_exo -59.23 -26.49 81.98 Favored 'Trans proline' 0 C--N 1.356 0.964 0 CA-C-N 121.096 1.427 . . . . 0.0 110.827 169.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' 1042 ' ' ALA . 38.7 t -75.09 -16.71 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.726 174.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.813 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 0.3 OUTLIER -64.57 -54.85 33.78 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.81 176.231 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 29.2 Cg_exo -62.2 -25.61 77.09 Favored 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 120.962 1.379 . . . . 0.0 110.406 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -68.11 -61.6 1.78 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.656 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.896 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 9.6 m -163.45 -50.22 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -172.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.529 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 4.9 t -53.28 -15.99 1.15 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -172.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.813 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 8.9 p-80 -47.94 -20.78 0.35 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 982' ' ' ARG . 9.1 tpt180 -76.86 -52.24 9.83 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.465 -0.894 . . . . 0.0 110.488 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.989 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.0 OUTLIER -76.61 -39.07 53.61 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.757 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' ' 981' ' ' HIS . 10.6 tt -63.06 -25.35 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.891 -176.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -73.5 -40.85 63.75 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.303 171.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.597 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 15.7 ptp -70.9 -51.2 27.63 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.842 -0.743 . . . . 0.0 112.052 -173.315 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.554 ' CB ' HG21 ' A' 1038 ' ' VAL . . . -78.76 -40.12 34.22 Favored 'General case' 0 C--O 1.217 -0.625 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' A' ' 991' ' ' LEU . 49.3 tt0 -61.56 -44.75 96.46 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.208 -177.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.43 -26.18 64.48 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.572 0.701 . . . . 0.0 109.136 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 8.6 tp -72.25 -37.35 69.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.823 178.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.036 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.4 mt -61.58 -53.42 56.5 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.982 176.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -57.03 -37.49 71.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.494 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 4.5 p -71.65 -38.03 70.75 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -176.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.639 ' HA ' ' HB3' ' A' ' 997' ' ' GLU . 4.3 m-20 -106.77 -31.13 8.54 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 119.529 -0.868 . . . . 0.0 112.825 -172.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.017 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.7 OUTLIER -59.79 -45.46 92.22 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.361 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.24 91.16 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.848 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.728 ' O ' ' HB2' ' A' 1001 ' ' LYS . 7.7 tp10 -53.03 -41.07 64.36 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.056 174.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.667 HD23 HD13 ' A' 1028 ' ' LEU . 40.9 tp -68.31 -38.99 82.14 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.243 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.785 ' HA ' HG11 ' A' ' 955' ' ' VAL . 77.7 mt -57.57 -51.21 72.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.298 0.57 . . . . 0.0 110.64 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.639 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.1 OUTLIER -78.47 -11.72 59.97 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.531 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.728 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 0.8 OUTLIER -84.42 -32.95 23.83 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.311 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 998' ' ' LEU . 43.7 mmm -78.71 -39.49 36.33 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' 1007 ' ' GLN . 84.1 tttt -55.79 -51.01 68.91 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.536 -1.211 . . . . 0.0 108.488 169.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.7 tp -57.28 -46.2 83.33 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.422 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -60.57 -44.48 96.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.385 0.612 . . . . 0.0 110.35 178.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.0 pp0? -76.68 -10.66 59.54 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.446 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' A' 1003 ' ' LYS . 28.7 tp60 -87.95 -16.71 33.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.413 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 60.9 t80 -128.6 11.14 6.21 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.951 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.677 HG21 ' HG3' ' A' ' 948' ' ' PRO . 3.7 p -51.51 110.02 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.689 0.757 . . . . 0.0 111.699 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.532 ' HG3' ' HB2' ' A' 1013 ' ' LEU . 24.7 ptm -149.48 169.75 20.17 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.576 178.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.8 m -59.13 114.46 2.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.217 -175.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' 1015 ' ' GLN . 19.4 m 74.46 -34.06 0.26 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.801 0.84 . . . . 0.0 112.932 172.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.532 ' HB2' ' HG3' ' A' 1010 ' ' MET . 4.3 mm? -82.06 -7.84 59.63 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.206 -0.309 . . . . 0.0 111.557 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.569 ' HG3' HG23 ' A' 1009 ' ' VAL . 1.0 OUTLIER -64.87 -36.81 85.56 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.702 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 19.7 pt20 -61.69 -32.28 72.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.453 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -50.44 -42.87 54.75 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 111.602 0.223 . . . . 0.0 111.602 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.609 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 4.5 m-30 -84.6 -19.62 32.74 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.225 0.536 . . . . 0.0 110.219 178.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.7 tttm -75.37 -32.11 60.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.49 177.208 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -76.44 -41.2 48.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -48.46 -40.14 25.3 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.554 166.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.623 ' HB3' ' O ' ' A' 1018 ' ' LYS . 1.3 tmt? -57.22 -46.71 82.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.252 173.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.57 -38.4 89.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.36 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.1 m -68.51 -37.08 79.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.894 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.91 -41.57 36.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.643 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.571 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -63.05 -31.79 73.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.258 0.552 . . . . 0.0 110.497 178.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' 1030 ' ' VAL . 6.0 t60 -71.64 -44.13 64.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.775 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.86 94.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.698 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 995' ' ' LEU . 5.5 tt -55.63 -53.53 55.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.178 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.77 -31.09 64.27 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.573 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.748 ' HA ' ' HG2' ' A' 1033 ' ' LYS . 80.6 t -66.06 -43.51 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.867 174.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.561 ' HB3' HD23 ' A' ' 991' ' ' LEU . 8.4 m-20 -51.35 -46.4 62.68 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.05 0.452 . . . . 0.0 109.838 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.652 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -60.9 -53.25 59.54 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.117 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.748 ' HG2' ' HA ' ' A' 1030 ' ' VAL . 15.0 ptmm? -65.75 -32.14 73.52 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -174.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.677 ' O ' HG23 ' A' 1038 ' ' VAL . 6.7 t-20 -73.43 -36.85 66.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.511 -0.475 . . . . 0.0 109.998 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.91 HD22 HD11 ' A' ' 991' ' ' LEU . 9.9 tp -79.81 -26.96 40.34 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.713 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.9 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.9 pp -64.79 -27.11 68.67 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.557 ' O ' ' HG2' ' A' 1041 ' ' GLN . 31.4 t70 -75.31 -45.91 36.7 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.219 -1.355 . . . . 0.0 108.921 170.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.989 HG13 ' HB3' ' A' ' 983' ' ' GLU . 55.7 t -53.31 -61.27 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.758 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.107 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.96 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.8 pt -81.33 -32.7 12.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -172.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 8.6 t0 -54.6 -44.53 73.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.201 166.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' A' 1045 ' ' LYS . 4.4 pt20 -78.47 -22.61 47.27 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.852 177.474 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.624 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.58 -55.35 30.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 118.478 0.581 . . . . 0.0 110.064 169.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.799 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.0 tpt180 -55.56 -33.86 64.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.131 175.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.507 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 66.1 tp -76.56 -26.3 54.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.439 175.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.896 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 69.0 mmtt -64.24 -34.63 78.55 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.0 ttp -71.41 -40.87 70.22 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.804 -1.543 . . . . 0.0 109.203 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.494 ' HB ' HD12 ' A' 1044 ' ' LEU . 48.6 mm -62.32 -35.02 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.809 172.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' 1045 ' ' LYS . 31.2 t -60.7 -40.19 91.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.316 -175.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -88.2 -17.14 31.49 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.561 -0.455 . . . . 0.0 111.621 -177.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 58.0 m -72.32 -33.63 67.49 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 171.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 54.32 82.3 0.25 Allowed Pre-proline 0 N--CA 1.461 0.1 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.509 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.77 12.16 2.46 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.222 2.614 . . . . 0.0 113.024 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 52.9 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.996 -178.092 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.84 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 6.7 tpt180 . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -75.73 39.88 0.18 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.757 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.794 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.1 OUTLIER 43.32 69.93 0.35 Allowed 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 124.229 1.011 . . . . 0.0 111.801 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 925' ' ' VAL . 2.1 t70 -47.02 -173.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 O-C-N 126.042 2.089 . . . . 0.0 113.058 -171.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.543 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 0.6 OUTLIER -46.54 -12.11 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.605 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.744 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -65.4 -54.65 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.751 171.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.458 ' CD1' ' HB2' ' A' 1040 ' ' ASP . 52.2 t80 -78.88 -29.13 44.21 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 122.144 0.973 . . . . 0.0 108.64 -176.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 38.5 mt-10 -65.41 -62.47 1.51 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.075 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -71.56 -32.52 68.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.985 -170.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.877 HG23 HD11 ' A' ' 965' ' ' LEU . 14.4 p -60.6 -38.02 77.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.44 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.546 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 55.6 m -65.49 -32.85 74.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 172.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.82 -33.2 67.44 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.866 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.533 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 21.0 tp -62.7 -43.0 99.93 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 117.383 0.591 . . . . 0.0 109.43 174.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 937' ' ' ILE . 27.4 t -63.53 -42.08 94.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.689 176.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.581 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.9 mmpt? -65.27 -31.01 71.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.02 -25.14 43.27 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.479 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.64 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.7 p -81.99 -11.32 12.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 C-N-CA 119.728 -0.789 . . . . 0.0 109.228 171.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 46.5 mm -72.34 -36.19 54.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 165.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.6 mm-40 -53.15 -38.05 62.39 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.372 170.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.511 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 57.5 ttp -58.16 -45.45 87.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.793 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.611 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 48.3 m -65.46 -33.07 75.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.666 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.765 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.2 m -77.46 -37.03 52.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.986 0.898 . . . . 0.0 108.943 -177.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.2 mmtp -70.01 -29.7 66.82 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.901 -1.499 . . . . 0.0 111.671 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 1.035 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 15.4 tt -79.49 -23.29 12.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.318 0.58 . . . . 0.0 110.462 178.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 940' ' ' SER . 84.2 mm-40 -55.27 -56.02 33.2 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 941' ' ' SER . 13.4 Cg_endo -91.31 -4.08 4.35 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.766 1.644 . . . . 0.0 115.421 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 950' ' ' GLU . . . -129.86 162.0 56.15 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.544 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 3.2 Cg_exo -80.61 -178.83 4.7 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 124.283 3.322 . . . . 0.0 110.908 168.22 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.929 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 5.9 Cg_endo -47.59 -18.37 0.9 Allowed 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 124.712 3.608 . . . . 0.0 115.689 -168.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.38 -4.18 1.73 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 170.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 1.035 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.1 OUTLIER -96.03 -27.87 14.9 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 173.155 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.929 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 11.1 m-85 -43.53 -47.36 7.28 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.046 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -69.75 -59.58 4.48 Favored Pre-proline 0 CA--C 1.555 1.152 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.814 177.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.046 ' HD3' HG13 ' A' ' 952' ' ' VAL . 51.2 Cg_exo -59.33 -35.92 95.66 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.338 2.026 . . . . 0.0 114.873 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.73 ' HE2' ' HA ' ' A' ' 951' ' ' TYR . 24.0 ptt? -64.01 -47.61 79.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -177.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' 1002 ' ' MET . 72.0 t -66.32 -27.0 39.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.55 174.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 88.2 tttt -62.71 -38.34 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.5 mm-40 -54.04 -45.37 71.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.883 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.656 ' HB ' HD21 ' A' ' 998' ' ' LEU . 1.9 t -71.71 -22.61 21.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.022 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.623 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.62 -45.79 34.37 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.109 -178.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.03 -21.61 66.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.826 0.346 . . . . 0.0 110.483 171.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 958' ' ' VAL . . . -62.34 -56.91 13.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.995 178.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 991' ' ' LEU . 8.3 tt -70.66 -27.26 63.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.195 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -54.51 45.12 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.022 170.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 24.8 m -53.89 -38.55 64.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.599 174.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.877 HD11 HG23 ' A' ' 929' ' ' VAL . 0.4 OUTLIER -64.33 -29.6 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.418 178.695 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.423 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 34.5 tp -63.97 -31.95 73.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.507 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.49 91.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.558 0.694 . . . . 0.0 110.045 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.744 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.9 m -62.99 -39.0 93.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.423 173.238 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 87.0 t -54.88 -31.73 25.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.286 174.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.531 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 0.9 OUTLIER -73.95 -23.19 59.46 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 176.62 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.637 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.4 mm-40 -67.62 -52.92 32.54 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 122.71 1.243 . . . . 0.0 109.001 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 9.6 p -66.8 -23.08 66.02 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.233 -1.348 . . . . 0.0 111.206 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.693 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 37.8 tp -55.76 -53.76 59.22 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-O 118.921 -0.561 . . . . 0.0 112.077 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 37.5 Cg_exo -61.09 -24.64 79.76 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.336 1.357 . . . . 0.0 111.246 170.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.691 HG12 ' HB ' ' A' ' 980' ' ' THR . 38.3 t -74.49 -13.94 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.334 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 1.015 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.3 tt -70.34 -53.16 10.72 Favored Pre-proline 0 C--O 1.234 0.27 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.407 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.529 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 33.9 Cg_exo -61.24 -25.5 80.71 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.178 1.252 . . . . 0.0 110.96 173.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.08 -64.97 0.77 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.22 174.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.833 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.4 m -163.46 -35.28 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -173.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 1.0 OUTLIER -61.47 -14.11 26.21 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -171.574 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 1.015 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 9.7 p-80 -50.15 -19.16 0.7 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -172.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.506 ' HE ' ' HA ' ' A' ' 982' ' ' ARG . 2.6 tpm_? -73.8 -52.72 12.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.58 176.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.925 ' HB3' HG13 ' A' 1038 ' ' VAL . 3.1 mp0 -77.05 -43.95 32.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.785 HD11 HG13 ' A' ' 969' ' ' VAL . 9.8 tp -56.97 -30.13 33.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.65 -174.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 10.5 mm-40 -73.02 -45.13 59.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.38 172.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.692 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 14.3 ptp -62.72 -54.41 39.61 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.648 -170.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.77 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -74.88 -35.55 62.3 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.14 -176.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.885 ' HA ' HD12 ' A' ' 991' ' ' LEU . 24.3 tp60 -59.59 -40.27 86.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.716 -176.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.721 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 69.1 mmtt -61.24 -42.35 98.46 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -65.75 -38.3 88.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.292 179.129 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.887 ' HB3' HD11 ' A' ' 962' ' ' LEU . 21.3 mt -61.8 -47.03 86.97 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.428 0.632 . . . . 0.0 109.888 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -57.81 -46.18 85.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.54 -177.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.7 p -70.81 -38.2 73.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.842 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 1.2 m-20 -91.42 -42.14 10.48 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -168.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.6 tm? -59.92 -40.45 88.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 171.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.48 69.63 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.97 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 9.8 pt-20 -68.71 -28.86 67.21 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.663 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.843 HD22 HD13 ' A' 1028 ' ' LEU . 1.1 tp -56.97 -49.56 75.32 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.523 175.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.639 ' O ' ' HG3' ' A' 1002 ' ' MET . 29.7 pt -73.55 -24.71 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 120.849 0.356 . . . . 0.0 111.471 -179.207 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.69 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.4 m-80 -87.12 -1.11 57.65 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 121.96 -0.463 . . . . 0.0 109.869 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1001 ' ' LYS . . . . . 1.0 ' HD2' ' HA ' ' A' 1021 ' ' MET . 5.5 ttpm? -82.99 -37.42 24.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.943 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -73.57 -37.64 65.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 173.151 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 53.8 tptt -56.63 -57.84 10.64 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.37 171.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.782 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 10.7 tp -55.29 -55.26 33.49 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.4 81.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 110.723 -177.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.7 -13.26 60.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.526 0.679 . . . . 0.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.7 tp-100 -79.79 -31.6 40.81 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.107 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.567 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 67.0 t80 -118.1 17.49 14.03 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.12 -176.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.529 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 7.3 p -57.7 94.9 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 122.224 1.011 . . . . 0.0 111.322 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.587 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 50.3 ttm -118.25 47.79 1.53 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.063 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 15.7 m 58.76 -92.02 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.021 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 49.5 m -86.04 -30.87 22.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.661 0.267 . . . . 0.0 111.282 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.587 ' HB2' ' HB3' ' A' 1010 ' ' MET . 3.2 mm? -77.31 -9.0 58.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.223 0.535 . . . . 0.0 110.425 -178.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' 1009 ' ' VAL . 1.1 tm0? -68.52 -21.53 64.57 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.369 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.812 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 26.2 tt0 -60.55 -32.42 71.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.107 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.29 -43.77 22.68 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.262 169.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.782 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 7.2 m-30 -87.07 -7.36 58.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.083 0.468 . . . . 0.0 110.495 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.812 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 30.3 tptt -75.64 -26.41 57.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.654 169.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 67.7 mttm -72.35 -57.24 4.36 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -47.97 -35.56 11.02 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.471 169.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1021 ' ' MET . . . . . 1.0 ' HA ' ' HD2' ' A' 1001 ' ' LYS . 7.9 tpt -51.68 -48.69 63.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.263 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.54 -53.4 23.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.647 0.26 . . . . 0.0 110.851 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 15.2 m -59.95 -46.22 90.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.124 -174.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.853 ' HB3' ' HD3' ' A' 1001 ' ' LYS . . . -74.59 -31.97 62.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.689 0.28 . . . . 0.0 111.681 -173.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.638 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -75.47 -37.54 60.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.956 0.408 . . . . 0.0 110.451 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 26.5 t60 -70.38 -30.3 67.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.278 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -68.95 -34.76 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.376 176.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.843 HD13 HD22 ' A' ' 998' ' ' LEU . 0.6 OUTLIER -63.95 -42.47 97.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 122.145 0.974 . . . . 0.0 109.715 173.118 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.9 -33.56 64.75 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.349 176.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' 1027 ' ' ALA . 82.6 t -66.63 -33.77 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 172.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.737 ' HB2' HD23 ' A' ' 991' ' ' LEU . 1.9 p30 -72.36 -38.78 68.45 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.476 ' HB2' HD23 ' A' ' 932' ' ' LEU . . . -61.15 -44.72 96.87 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.692 171.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.651 ' O ' ' HG ' ' A' 1036 ' ' LEU . 60.0 tttm -63.76 -42.13 97.88 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.792 -176.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.599 ' O ' HG23 ' A' 1038 ' ' VAL . 66.1 t30 -73.2 -40.01 65.09 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.375 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.774 ' O ' HG12 ' A' 1039 ' ' ILE . 18.1 tp -73.76 -31.65 63.43 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.597 -177.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.84 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.3 pp -62.29 -37.02 83.92 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.481 ' N ' HD12 ' A' 1036 ' ' LEU . 29.2 t70 -75.67 -37.92 59.18 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.386 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.925 HG13 ' HB3' ' A' ' 983' ' ' GLU . 4.8 t -53.59 -59.07 2.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.98 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.81 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.5 pt -85.83 -24.73 6.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.153 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.458 ' HB2' ' CD1' ' A' ' 926' ' ' TYR . 19.7 t70 -61.08 -39.27 89.3 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.475 162.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.719 ' O ' ' HG2' ' A' 1045 ' ' LYS . 35.7 mt-30 -68.21 -35.08 77.42 Favored 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.393 171.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.629 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.98 -49.49 71.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.122 0.487 . . . . 0.0 110.717 174.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.84 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -47.4 -41.46 20.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.624 172.216 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.527 ' N ' ' HD3' ' A' 1043 ' ' ARG . 26.3 tp -79.97 -32.44 39.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.278 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.833 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 31.6 mmtp -63.13 -42.18 99.46 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.325 0.583 . . . . 0.0 109.973 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 25.6 ttt -69.12 -33.65 73.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.81 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.587 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 31.6 mm -69.53 -41.86 80.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.934 173.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 70.5 m -54.38 -28.03 40.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.615 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.49 -45.96 9.04 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 18.9 m -61.16 -37.97 84.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.091 0.472 . . . . 0.0 110.633 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.459 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 4.9 mtp180 -80.41 122.05 82.18 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 173.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 11.3 Cg_exo -72.51 44.07 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.317 2.678 . . . . 0.0 113.075 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 38.5 m-70 . . . . . 0 C--O 1.245 0.864 0 CA-C-O 118.694 -0.669 . . . . 0.0 110.439 -179.894 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 2.2 tpm_? . . . . . 0 N--CA 1.449 -0.495 0 CA-C-O 120.742 0.306 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.403 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 38.3 m -123.59 46.14 2.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.684 -174.199 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 44.9 55.95 5.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.881 0.872 . . . . 0.0 112.934 173.491 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.612 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 23.8 t0 -47.8 -175.05 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.717 0 O-C-N 125.399 1.687 . . . . 0.0 111.845 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.491 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.2 tmtm? -37.0 -21.02 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.12 0.968 . . . . 0.0 112.874 -179.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.887 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 6.9 m -59.69 -51.44 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 O-C-N 122.144 -0.348 . . . . 0.0 111.299 173.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 27.4 t80 -75.63 -31.89 60.03 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -173.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.76 -58.07 7.23 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.874 -1.512 . . . . 0.0 111.651 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -70.6 -30.43 67.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.123 -173.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.673 HG22 HD11 ' A' ' 965' ' ' LEU . 61.2 t -66.19 -41.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.973 -0.691 . . . . 0.0 109.884 175.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.686 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 67.3 m -60.19 -35.86 76.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 169.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -59.52 -33.96 79.1 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.519 174.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.709 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.3 tt -63.7 -45.9 87.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.048 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.8 t -57.09 -42.54 79.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.915 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.686 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -63.71 -40.85 97.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.418 178.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.717 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.16 -26.55 42.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.959 -177.183 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' A' ' 939' ' ' MET . 15.0 p -79.01 -14.53 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.697 0.761 . . . . 0.0 109.128 172.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 24.4 mm -69.83 -31.43 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 167.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.568 ' HG3' ' HA ' ' A' ' 935' ' ' ALA . 36.2 mt-10 -61.27 -39.05 88.97 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.939 174.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.749 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 43.6 ttp -51.37 -47.06 62.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.334 172.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.621 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.9 t -71.9 -39.18 69.74 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.048 178.17 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 46.7 m -71.71 -50.88 26.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.159 0.504 . . . . 0.0 110.564 -169.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.631 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -82.98 -11.48 58.1 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.566 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -77.17 -45.79 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.212 0.46 . . . . 0.0 111.378 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -59.05 -46.81 99.42 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -173.349 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.609 ' HD3' ' HG3' ' A' ' 944' ' ' GLN . 79.2 Cg_endo -87.96 16.08 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.438 1.425 . . . . 0.0 113.545 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -125.72 154.26 73.15 Favored Pre-proline 0 C--N 1.328 -0.364 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.39 175.27 10.91 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 123.157 2.571 . . . . 0.0 111.821 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.966 ' HB3' HE21 ' A' 1006 ' ' GLN . 88.7 Cg_exo -50.24 -35.39 43.22 Favored 'Trans proline' 0 C--O 1.248 0.998 0 C-N-CA 123.118 2.545 . . . . 0.0 113.121 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -55.18 -25.27 31.45 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.857 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.696 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 53.3 mm-40 -106.94 -3.16 20.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.732 ' O ' ' HG3' ' A' ' 954' ' ' MET . 9.7 m-30 -61.31 -47.31 86.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 173.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.928 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.58 -44.01 12.2 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.876 177.019 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.928 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.5 Cg_exo -55.02 -29.72 66.34 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.805 1.67 . . . . 0.0 115.239 171.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 0.0 OUTLIER -72.95 -30.69 64.05 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.968 0.889 . . . . 0.0 109.644 178.389 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.784 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.6 OUTLIER -71.37 -26.2 26.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.003 174.455 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.651 ' HE3' ' HA ' ' A' ' 953' ' ' PRO . 8.6 mtmp? -58.15 -38.53 76.76 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.438 175.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' A' ' 957' ' ' GLU . 1.1 mm-40 -55.59 -45.98 77.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.711 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 2.2 t -65.42 -32.77 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.002 0.43 . . . . 0.0 110.788 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.79 -41.67 97.46 Favored Glycine 0 C--O 1.228 -0.232 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.775 177.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 62.6 tp -68.91 -33.47 73.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.242 0.544 . . . . 0.0 109.653 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.717 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -53.64 -57.07 12.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.766 177.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.953 HD22 ' HG ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -74.68 -21.13 59.57 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.578 -179.497 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -53.84 13.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.831 0.348 . . . . 0.0 110.322 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 7.0 m -58.22 -27.81 64.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.907 0.861 . . . . 0.0 109.488 173.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.673 HD11 HG22 ' A' ' 929' ' ' VAL . 17.4 tp -70.76 -37.27 73.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.889 178.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -51.01 -33.39 24.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.882 172.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -62.5 -48.84 77.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.798 0.332 . . . . 0.0 110.413 173.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.6 m -58.35 -46.1 86.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.306 173.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.794 HG13 HD11 ' A' ' 984' ' ' ILE . 96.6 t -52.43 -30.25 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.968 175.011 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.4 t70 -70.98 -29.06 64.94 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.289 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.623 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.5 mm-40 -65.57 -57.04 9.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.53 1.157 . . . . 0.0 109.036 172.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.492 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 53.0 p -58.5 -22.98 56.86 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.0 -1.0 . . . . 0.0 113.065 174.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.668 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 43.0 tp -56.83 -54.24 56.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.556 -179.033 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.668 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 52.3 Cg_exo -57.91 -23.71 60.95 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 121.6 1.533 . . . . 0.0 111.648 168.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.58 HG12 ' HB ' ' A' ' 980' ' ' THR . 44.0 t -74.89 -16.22 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.815 175.238 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 984' ' ' ILE . 1.0 OUTLIER -69.01 -48.08 28.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 118.973 -0.537 . . . . 0.0 111.641 176.688 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.528 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 39.9 Cg_exo -60.5 -26.51 82.96 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 121.156 1.237 . . . . 0.0 111.103 170.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.631 ' HA ' ' OE1' ' A' 1049 ' ' GLN . . . -70.42 -66.6 0.58 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.803 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.832 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.0 m -165.46 -27.27 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -174.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.663 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 2.8 t -65.13 -12.81 54.97 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -172.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.551 ' CD2' ' HG3' ' A' ' 985' ' ' GLU . 3.7 t60 -45.8 -44.5 14.11 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 122.761 0.424 . . . . 0.0 111.621 -169.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -55.18 -53.53 54.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.038 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.0 OUTLIER -75.2 -43.45 51.88 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.794 HD11 HG13 ' A' ' 969' ' ' VAL . 11.3 tp -62.64 -26.62 41.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.297 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.551 ' HG3' ' CD2' ' A' ' 981' ' ' HIS . 1.3 mm-40 -74.08 -38.32 63.93 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.366 171.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 12.1 ptp -66.19 -62.44 1.48 Allowed 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.175 -174.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.705 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.23 -36.61 39.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -173.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.673 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.5 OUTLIER -69.47 -43.14 73.81 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.56 -175.064 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -66.36 -27.66 68.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.511 0.672 . . . . 0.0 109.244 173.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.559 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.8 tp -72.01 -39.92 68.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.494 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.852 HD11 HD22 ' A' 1035 ' ' LEU . 29.1 mt -59.76 -61.14 2.84 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.588 178.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -47.17 -37.8 10.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.113 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 71.0 m -67.43 -57.57 6.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.661 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.603 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 3.7 m-20 -93.66 -15.99 24.75 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.953 ' HG ' HD22 ' A' ' 962' ' ' LEU . 2.5 tm? -61.22 -50.6 72.41 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.626 1.103 . . . . 0.0 108.338 163.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.775 ' O ' ' HB3' ' A' 1000 ' ' ASN . . . -52.9 -30.73 35.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.544 172.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.71 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.8 tp10 -64.32 -45.24 88.75 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.551 HD21 ' O ' ' A' 1024 ' ' ALA . 4.1 mm? -77.54 -50.39 12.69 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.51 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.784 ' HA ' HG11 ' A' ' 955' ' ' VAL . 15.6 tt -57.0 -21.03 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 121.696 0.76 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.775 ' HB3' ' O ' ' A' ' 996' ' ' ALA . 0.6 OUTLIER -109.44 -22.19 12.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.578 -173.792 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.71 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 9.0 tptm -84.48 -36.45 22.26 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 123.126 0.266 . . . . 0.0 111.029 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 0.3 OUTLIER -78.69 -36.07 44.13 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.2 ttpt -58.73 -37.59 76.5 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 167.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.707 ' HB2' ' O ' ' A' 1000 ' ' ASN . 8.4 tt -68.85 -50.13 52.49 Favored 'General case' 0 C--O 1.214 -0.776 0 O-C-N 123.774 0.671 . . . . 0.0 110.295 -176.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' 1017 ' ' TYR . . . -55.55 -46.39 77.13 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.804 0.811 . . . . 0.0 109.959 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.966 HE21 ' HB3' ' A' ' 948' ' ' PRO . 0.9 OUTLIER -76.19 -13.54 60.18 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.777 -178.707 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -95.96 -40.42 9.29 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.412 0.625 . . . . 0.0 111.593 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 51.3 t80 -89.51 1.98 55.18 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.803 -176.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.706 HG23 ' HG3' ' A' 1014 ' ' GLN . 5.9 p -30.4 125.08 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 113.73 -1.577 . . . . 0.0 114.313 -179.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.467 ' SD ' HD22 ' A' 1013 ' ' LEU . 41.5 ttm -133.22 148.2 52.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.669 171.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 8.0 m -51.0 112.25 0.69 Allowed 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.391 0.432 . . . . 0.0 111.345 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 t 75.24 -41.52 0.46 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.877 0.871 . . . . 0.0 112.238 176.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.467 HD22 ' SD ' ' A' 1010 ' ' MET . 8.8 mp -72.38 -8.44 54.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.706 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -54.58 -41.05 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.521 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -59.17 -25.79 64.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.004 -172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -54.52 -58.5 7.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.35 0.595 . . . . 0.0 109.847 173.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.604 ' HB2' ' HA ' ' A' 1005 ' ' ALA . 0.1 OUTLIER -55.0 -33.14 62.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.539 177.759 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 58.2 tttm -71.38 -45.47 62.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.904 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.62 -27.97 64.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.857 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.91 -44.08 94.49 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 170.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' A' 1002 ' ' MET . 1.7 tmt? -61.82 -42.08 98.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.581 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.91 -39.04 76.97 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.162 0.506 . . . . 0.0 110.784 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 31.4 m -69.57 -46.74 65.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.149 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.551 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -60.67 -36.09 77.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.543 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.488 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -59.04 -35.8 73.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.086 0.47 . . . . 0.0 110.754 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.587 ' O ' HG23 ' A' 1030 ' ' VAL . 16.2 t-160 -67.31 -31.7 72.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.78 177.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.501 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -72.35 -55.74 6.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.062 -178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 995' ' ' LEU . 24.5 tp -58.74 -35.85 73.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.046 0.451 . . . . 0.0 111.531 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.41 -36.93 66.99 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.879 0.371 . . . . 0.0 111.548 170.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' 1026 ' ' HIS . 82.6 t -64.14 -36.18 76.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 175.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.603 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 11.0 m-20 -60.59 -44.56 96.11 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.982 0.42 . . . . 0.0 110.486 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.538 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -59.52 -54.0 51.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.514 174.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -53.37 -38.29 63.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' 1038 ' ' VAL . 54.0 t30 -71.58 -54.02 11.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.186 -178.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.852 HD22 HD11 ' A' ' 991' ' ' LEU . 15.0 tp -57.52 -33.19 67.81 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.885 179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.581 ' N ' HG11 ' A' ' 929' ' ' VAL . 38.7 tp -52.62 -47.29 67.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.857 0.837 . . . . 0.0 109.842 176.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.3 t70 -68.51 -42.15 78.94 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.355 174.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.038 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.0 t -52.97 -61.91 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.459 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.781 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.887 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -82.45 -30.2 9.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.777 ' H ' HD12 ' A' 1039 ' ' ILE . 44.1 t0 -56.88 -37.49 71.45 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 165.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' 1045 ' ' LYS . 2.7 mp0 -73.15 -36.56 66.68 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 114.536 -1.211 . . . . 0.0 109.63 172.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.664 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.49 -52.44 59.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.24 0.543 . . . . 0.0 111.232 176.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.936 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 0.3 OUTLIER -58.83 -31.0 68.08 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.94 179.198 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.651 HD12 ' HB3' ' A' ' 920' ' ' ARG . 11.1 mp -77.88 -31.85 51.59 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.943 -0.117 . . . . 0.0 111.22 171.193 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.832 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 32.9 mmtp -59.87 -36.93 77.94 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.812 0.815 . . . . 0.0 108.915 175.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 42.2 ttp -69.22 -36.81 77.61 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.473 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' 1051 ' ' ARG . 48.6 mm -64.69 -42.45 95.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.539 172.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 37.3 m -55.98 -46.61 78.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.841 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.631 ' OE1' ' HA ' ' A' ' 978' ' ' ALA . 24.9 tt0 -59.46 -55.71 31.16 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.575 0.226 . . . . 0.0 111.581 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 33.8 t -159.46 -9.34 0.06 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.657 -0.417 . . . . 0.0 112.066 -175.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.549 ' HA ' ' HA ' ' A' 1047 ' ' ILE . 16.5 ttp180 59.8 99.14 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.793 -175.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -56.8 125.96 20.71 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.014 2.476 . . . . 0.0 113.236 -176.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 16.3 p80 . . . . . 0 C--O 1.248 0.974 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.635 176.984 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.978 ' HG3' ' HB2' ' A' 1043 ' ' ARG . 3.4 mmp_? . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 32.4 t 63.19 16.52 9.46 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -166.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 923' ' ' ASP . 2.3 m-20 55.65 72.33 0.49 Allowed 'General case' 0 CA--C 1.498 -1.047 0 CA-C-N 114.326 -1.307 . . . . 0.0 109.602 -174.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -46.63 -174.75 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.532 0 O-C-N 126.299 2.249 . . . . 0.0 113.074 -168.676 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.601 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 3.1 tmtm? -46.9 -8.05 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.731 0.812 . . . . 0.0 112.307 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.735 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 0.0 OUTLIER -72.26 -49.76 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 C-N-CA 122.704 0.402 . . . . 0.0 110.896 174.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 14.9 t80 -73.3 -25.81 60.81 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.111 0.958 . . . . 0.0 108.416 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 930' ' ' THR . 97.1 mt-10 -73.54 -57.4 4.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.333 -177.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -66.49 -32.79 74.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.491 -171.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 1.079 HG11 ' HA ' ' A' 1036 ' ' LEU . 12.2 p -67.38 -40.97 85.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.789 177.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.59 HG22 ' HD2' ' A' ' 934' ' ' LYS . 59.6 m -53.8 -31.99 51.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.821 0.343 . . . . 0.0 110.694 166.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 931' ' ' GLY . . . . . 0.508 ' HA2' ' HB2' ' A' ' 934' ' ' LYS . . . -66.99 -31.97 79.52 Favored Glycine 0 C--O 1.227 -0.307 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 176.152 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 1.033 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.57 -51.06 70.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 173.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.5 t -60.87 -31.37 49.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.275 0.56 . . . . 0.0 110.906 174.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 930' ' ' THR . 0.0 OUTLIER -72.13 -43.53 64.55 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.008 -178.572 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 1.025 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.83 -25.26 56.11 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 122.201 -0.312 . . . . 0.0 111.349 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.623 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -75.87 -13.05 14.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 119.636 -0.825 . . . . 0.0 109.644 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 37.4 mm -71.11 -31.04 43.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 168.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 12.2 mm-40 -57.88 -40.71 80.88 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 171.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.467 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 47.6 ttp -56.47 -45.22 81.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.572 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.48 ' O ' HG22 ' A' ' 943' ' ' ILE . 16.2 p -73.19 -31.54 64.27 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.626 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 8.0 p -78.5 -40.8 34.23 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -177.292 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.503 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 4.4 mmtp -52.37 -47.16 66.34 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.47 174.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.603 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 16.5 tt -70.67 -22.35 23.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.522 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.828 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 16.2 mm100 -55.68 -61.98 5.33 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.579 178.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 12.2 Cg_endo -92.92 -31.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.833 1.689 . . . . 0.0 114.086 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -83.82 150.41 58.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.218 0.532 . . . . 0.0 112.371 -169.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.587 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 72.6 Cg_endo -83.87 -177.83 3.28 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.371 2.714 . . . . 0.0 113.156 -177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.587 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 4.8 Cg_endo -49.3 -36.57 38.14 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 124.245 3.297 . . . . 0.0 113.96 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -55.06 -20.17 8.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.664 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.626 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 61.4 mm-40 -107.71 -4.96 17.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.591 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.9 m-30 -57.61 -42.19 82.75 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.49 -46.87 3.3 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 119.181 -1.007 . . . . 0.0 112.531 177.347 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 78.2 Cg_exo -57.49 -29.45 84.78 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.562 1.508 . . . . 0.0 114.676 171.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.603 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 19.6 ptp -73.81 -31.88 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.446 0.641 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -72.29 -25.6 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.325 174.111 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 17.9 tppt? -58.57 -41.68 86.22 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.99 -45.82 68.01 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.884 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -66.69 -29.71 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.022 178.119 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.545 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -67.4 -41.69 90.57 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.91 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.72 -40.6 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 109.901 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 1.033 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -48.45 -57.48 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 173.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.756 ' HB2' HD13 ' A' ' 995' ' ' LEU . 5.2 tt -70.52 -28.9 65.3 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 119.162 -1.015 . . . . 0.0 111.651 177.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -56.8 -57.24 13.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.701 0.286 . . . . 0.0 110.746 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 1.7 p -58.57 -44.55 89.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.18 0.514 . . . . 0.0 110.365 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 57.1 tp -51.1 -41.58 60.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.133 175.187 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 73.8 mt -54.82 -36.52 65.07 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.93 93.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.972 0.415 . . . . 0.0 109.978 175.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.684 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -63.85 -38.94 92.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.016 173.044 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 82.0 t -54.79 -31.9 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 O-C-N 122.235 -0.291 . . . . 0.0 110.802 172.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.509 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 2.7 m-20 -73.03 -22.48 60.63 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.757 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.5 mm-40 -74.23 -44.35 53.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.176 0.988 . . . . 0.0 108.638 171.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.503 ' OG ' HG21 ' A' ' 980' ' ' THR . 32.8 t -69.2 -24.13 63.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.892 177.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.719 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 55.7 tp -59.91 -50.68 85.33 Favored Pre-proline 0 C--O 1.218 -0.58 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.505 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 11.5 Cg_endo -61.12 -26.17 82.22 Favored 'Trans proline' 0 C--N 1.355 0.908 0 CA-C-N 121.424 1.544 . . . . 0.0 110.927 170.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.9 t -77.15 -11.08 13.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.222 174.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 1.9 tt -69.16 -53.23 14.07 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.62 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.462 ' N ' HD23 ' A' ' 976' ' ' LEU . 45.0 Cg_endo -69.44 -19.46 37.61 Favored 'Trans proline' 0 C--N 1.358 1.048 0 CA-C-N 120.457 1.199 . . . . 0.0 110.933 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -67.97 -55.31 13.2 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.694 172.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.703 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 31.1 m -166.11 -35.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -175.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.789 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.4 m -64.17 -18.43 64.47 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -168.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.772 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 11.6 t-160 -48.81 -26.43 2.39 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -172.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -72.2 -56.1 6.12 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.383 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.743 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.11 -42.65 62.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.626 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.789 ' HB ' HG22 ' A' ' 980' ' ' THR . 12.0 tt -58.76 -30.94 43.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.195 -174.015 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -72.68 -37.73 67.8 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.285 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.609 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 13.6 ptp -67.23 -59.06 3.74 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.629 -176.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.825 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -68.41 -45.57 72.28 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 1.128 ' HA ' HD12 ' A' ' 991' ' ' LEU . 34.6 tt0 -58.23 -44.32 88.19 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.616 -175.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -61.6 -33.88 74.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.424 0.63 . . . . 0.0 109.933 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.65 -42.55 61.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.469 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.128 HD12 ' HA ' ' A' ' 988' ' ' GLN . 14.5 mt -53.43 -58.13 8.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 174.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -45.65 -48.15 14.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.184 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 4.5 p -73.06 -47.62 43.07 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.011 -176.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.482 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.1 m-20 -82.09 -38.67 24.51 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -170.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -56.26 -60.21 3.83 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.623 0.647 . . . . 0.0 109.798 170.954 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.45 -23.46 38.96 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.899 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 993' ' ' SER . 20.5 tt0 -70.56 -43.24 69.89 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.297 -0.961 . . . . 0.0 108.554 177.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.634 ' HA ' ' HB1' ' A' 1024 ' ' ALA . 0.3 OUTLIER -60.84 -47.54 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.628 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.7 mt -55.63 -68.55 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.381 -179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.824 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.1 OUTLIER -54.05 -18.91 4.06 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 114.395 -1.275 . . . . 0.0 113.108 177.897 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.64 ' HG3' ' HB2' ' A' 1024 ' ' ALA . 24.6 mmtp -85.26 -37.69 19.74 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.873 0.761 . . . . 0.0 111.395 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 998' ' ' LEU . 57.2 mtp -79.18 -34.78 42.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.652 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.9 tttm -63.54 -40.94 98.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 113.568 -1.651 . . . . 0.0 108.699 170.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.824 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.3 tp -60.77 -46.82 88.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.041 173.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -58.97 -45.18 91.18 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.6 0.714 . . . . 0.0 109.989 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -77.12 -6.58 53.42 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.261 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp-100 -91.09 -22.46 20.71 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.319 175.081 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 64.6 t80 -121.45 20.08 11.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.48 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.564 HG23 ' HG3' ' A' 1014 ' ' GLN . 5.6 p -61.18 88.7 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 122.196 0.998 . . . . 0.0 110.706 176.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.665 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 11.0 tpt -121.2 67.79 0.88 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.819 -177.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 9.7 m 61.36 -89.44 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.001 177.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.3 t -105.53 -8.6 17.93 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 -177.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.665 ' HB2' ' HB3' ' A' 1010 ' ' MET . 87.5 mt -82.31 -9.08 59.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.287 0.565 . . . . 0.0 110.174 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.564 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.4 OUTLIER -67.06 -45.9 75.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.698 -175.556 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.542 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 62.8 tt0 -53.59 -36.08 61.56 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.37 -59.3 4.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.116 0.484 . . . . 0.0 111.44 175.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.687 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.1 m-30 -62.27 -35.74 79.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.858 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.737 ' O ' ' HG2' ' A' 1021 ' ' MET . 86.2 tttt -55.63 -39.35 70.7 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.575 172.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.431 ' HD2' HD12 ' A' 1022 ' ' LEU . 26.5 tptp -68.29 -44.19 76.01 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -57.73 -33.08 68.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.96 174.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.737 ' HG2' ' O ' ' A' 1018 ' ' LYS . 9.0 ptt? -75.34 -25.66 57.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' 1018 ' ' LYS . 94.1 mt -71.15 -38.07 72.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.009 0.433 . . . . 0.0 109.857 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 98.9 m -59.76 -41.39 90.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.994 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.64 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -64.79 -38.39 90.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.159 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -62.6 -38.62 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.457 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.538 ' O ' HG23 ' A' 1030 ' ' VAL . 1.7 t-80 -68.78 -39.38 80.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.47 174.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.482 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -63.77 -51.64 63.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.782 -177.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.2 OUTLIER -60.79 -43.87 97.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.868 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.536 ' N ' HD23 ' A' 1028 ' ' LEU . . . -53.6 -28.3 31.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.819 173.547 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 1026 ' ' HIS . 88.5 t -72.4 -45.71 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 121.221 -0.192 . . . . 0.0 110.736 174.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.769 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.3 p30 -64.49 -47.27 79.58 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.632 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' 1036 ' ' LEU . . . -52.96 -29.08 26.82 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.281 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' 1036 ' ' LEU . 35.7 ttpt -83.49 -48.77 9.94 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.451 0.644 . . . . 0.0 109.308 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.539 ' O ' HG23 ' A' 1038 ' ' VAL . 2.8 t-20 -61.54 -47.97 83.13 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.349 -176.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.864 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 12.6 tp -67.75 -33.22 74.42 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.798 -177.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1036 ' ' LEU . . . . . 1.079 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -58.28 -27.43 64.03 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.543 0.687 . . . . 0.0 109.66 177.535 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.0 t0 -92.09 -34.49 14.35 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.636 -1.165 . . . . 0.0 108.694 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.864 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 21.7 t -63.62 -53.32 46.42 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 CA-C-N 115.423 -0.808 . . . . 0.0 113.108 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.794 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.1 pt -82.01 -30.49 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 122.432 -0.168 . . . . 0.0 111.228 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.913 ' O ' ' HD3' ' A' 1043 ' ' ARG . 19.9 t0 -53.78 -29.78 41.75 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 118.532 -1.267 . . . . 0.0 110.662 157.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' 1037 ' ' ASP . 58.9 mt-30 -81.46 -28.73 34.01 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 120.372 -1.455 . . . . 0.0 109.742 169.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.18 -52.94 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.823 0.344 . . . . 0.0 110.843 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.978 ' HB2' ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -62.34 -33.14 74.12 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 177.118 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.512 ' O ' ' HB ' ' A' 1047 ' ' ILE . 3.7 tp -79.08 -22.4 45.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.53 -0.731 . . . . 0.0 110.493 175.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.703 ' HG3' ' HB3' ' A' ' 979' ' ' SER . 13.7 mptt -62.75 -37.0 84.86 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 166.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.434 ' HB3' ' O ' ' A' 1043 ' ' ARG . 22.9 ttt -67.96 -36.11 79.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.373 174.222 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' A' 1044 ' ' LEU . 27.9 mm -60.65 -43.98 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.91 172.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.591 ' HB3' ' O ' ' A' 1045 ' ' LYS . 35.9 t -47.75 -38.06 14.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.492 174.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -91.82 -53.36 4.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.629 0.252 . . . . 0.0 111.295 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.465 ' OG ' ' HB2' ' A' 1053 ' ' HIS . 26.1 t -128.41 77.42 1.77 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.161 0.505 . . . . 0.0 110.632 -177.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.659 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 58.1 ttt180 -66.53 -56.87 13.72 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.307 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.659 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 16.9 Cg_exo -67.9 -18.8 46.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.216 1.944 . . . . 0.0 113.055 -174.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.465 ' HB2' ' OG ' ' A' 1050 ' ' SER . 28.7 m170 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.296 -0.859 . . . . 0.0 109.942 -177.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.93 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 7.4 tpt180 . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 8.1 p -80.45 39.22 0.45 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -176.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.698 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.4 OUTLIER 47.93 56.81 6.73 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.047 0.939 . . . . 0.0 112.339 172.869 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 925' ' ' VAL . 5.0 p-10 -47.24 -171.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 O-C-N 125.946 2.029 . . . . 0.0 113.632 -175.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.615 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.3 tmtp? -42.04 -8.54 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.568 1.147 . . . . 0.0 113.403 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 1.04 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 2.7 m -73.4 -53.81 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 O-C-N 122.078 -0.389 . . . . 0.0 110.9 174.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.522 ' HD1' ' HB2' ' A' 1040 ' ' ASP . 62.3 t80 -76.69 -28.81 56.05 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.055 0.931 . . . . 0.0 108.829 -172.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 930' ' ' THR . 5.3 mm-40 -74.91 -52.27 11.67 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.522 -177.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.615 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 58.1 t30 -73.35 -31.04 63.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -173.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.971 HG11 HD11 ' A' 1039 ' ' ILE . 11.5 p -65.03 -42.22 94.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.596 175.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.675 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 73.6 m -52.0 -30.48 25.38 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-O 120.718 0.294 . . . . 0.0 110.495 166.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -60.83 -31.61 76.47 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.196 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.868 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.3 tt -66.92 -41.76 86.53 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 937' ' ' ILE . 40.1 t -63.89 -32.99 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.203 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -73.84 -31.18 63.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.37 0.605 . . . . 0.0 109.434 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.59 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -77.98 -30.39 50.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.141 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 933' ' ' VAL . 11.5 p -79.15 -12.73 13.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 175.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -70.1 -38.73 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 165.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.525 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 43.5 mt-10 -61.26 -44.86 96.56 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.416 172.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.586 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 25.2 ttt -56.88 -45.56 82.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.703 176.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 13.7 t -66.45 -34.03 77.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.61 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.657 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 47.6 m -76.46 -28.59 56.59 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.081 0.943 . . . . 0.0 109.245 -177.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.577 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 20.4 mmtm -69.7 -62.31 1.43 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.222 176.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.829 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -59.62 -31.78 47.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.401 -167.689 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.731 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 50.6 mt-30 -73.89 -64.24 0.78 Allowed Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.337 -175.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.8 Cg_endo -90.29 14.73 2.01 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.151 1.234 . . . . 0.0 114.675 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -127.51 153.61 77.43 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 121.875 -0.516 . . . . 0.0 111.164 175.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.511 ' HB2' ' OE1' ' A' ' 949' ' ' GLU . 4.2 Cg_exo -81.02 176.22 9.12 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.637 2.891 . . . . 0.0 112.629 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.709 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 81.6 Cg_exo -50.97 -32.26 37.6 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.755 2.97 . . . . 0.0 114.792 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.511 ' OE1' ' HB2' ' A' ' 947' ' ' PRO . 1.8 pm0 -55.65 -32.17 62.98 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.904 175.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.592 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER -91.97 -1.91 57.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 176.549 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.749 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.6 m-30 -65.83 -32.89 74.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.992 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.17 -51.61 2.67 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 119.129 -1.028 . . . . 0.0 112.046 173.204 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.992 ' HD3' HG13 ' A' ' 952' ' ' VAL . 81.1 Cg_exo -52.99 -30.3 48.17 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.167 1.911 . . . . 0.0 114.897 170.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.829 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.2 ptt? -65.25 -42.29 93.46 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.633 0.73 . . . . 0.0 109.739 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.573 ' HB ' ' HB3' ' A' 1002 ' ' MET . 79.0 t -73.62 -26.3 21.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.913 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.6 OUTLIER -53.32 -45.75 69.15 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.872 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.8 mm-40 -55.13 -48.59 73.45 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.981 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 4.1 m -74.01 -28.34 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.494 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.49 -43.53 44.56 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.646 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.458 HD23 ' HD3' ' A' ' 956' ' ' LYS . 4.3 mm? -62.33 -38.74 90.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.185 -0.508 . . . . 0.0 109.674 172.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.868 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -50.18 -55.85 13.46 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 171.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 2.4 tm? -66.43 -34.86 78.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.111 0.414 . . . . 0.0 110.621 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -56.84 -53.35 58.91 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 122.109 -0.369 . . . . 0.0 111.254 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.442 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 26.3 m -64.35 -40.15 95.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.301 0.572 . . . . 0.0 110.126 177.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 23.5 tp -53.11 -39.69 63.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.562 172.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.81 -27.7 63.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -65.11 -42.49 93.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 171.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.629 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.3 m -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.729 171.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -54.49 -30.62 21.89 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.446 174.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.642 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 29.5 t70 -75.89 -26.87 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.512 0.196 . . . . 0.0 111.161 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.4 mm-40 -70.77 -48.65 53.21 Favored 'General case' 0 C--O 1.247 0.921 0 CA-C-O 122.707 1.242 . . . . 0.0 107.943 173.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.541 ' OG ' HG21 ' A' ' 980' ' ' THR . 35.3 t -69.58 -22.98 63.48 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 114.361 -1.291 . . . . 0.0 110.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 1.087 ' HA ' HD13 ' A' ' 976' ' ' LEU . 1.7 tm? -54.43 -55.29 38.98 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.593 -177.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.642 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.3 Cg_endo -58.05 -26.8 77.01 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 120.749 1.303 . . . . 0.0 110.682 170.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.0 -16.28 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.62 175.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 1.087 HD13 ' HA ' ' A' ' 973' ' ' LEU . 10.8 mp -58.87 -61.37 7.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-O 118.983 -0.532 . . . . 0.0 110.553 173.112 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.628 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 50.5 Cg_exo -57.05 -31.31 89.82 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 121.68 1.587 . . . . 0.0 111.539 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' 1049 ' ' GLN . . . -61.02 -54.78 40.7 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.77 174.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.818 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -171.11 -37.8 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -176.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.653 HG22 ' HB ' ' A' ' 984' ' ' ILE . 25.2 m -59.27 -22.09 60.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -170.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.589 ' HA ' HG22 ' A' ' 984' ' ' ILE . 0.1 OUTLIER -52.66 -20.48 3.12 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -173.085 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -70.51 -55.94 7.75 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.738 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.04 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -75.23 -42.87 54.37 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.98 HD13 HD11 ' A' ' 976' ' ' LEU . 18.6 tt -60.85 -36.4 71.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 119.025 -1.07 . . . . 0.0 109.047 -173.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -59.42 -40.63 87.32 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.969 -0.693 . . . . 0.0 111.488 171.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.613 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 8.1 ptp -68.07 -63.25 1.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.588 -177.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.741 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.12 -33.47 50.48 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 24.4 tm0? -71.51 -41.43 69.24 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.383 0.992 . . . . 0.0 110.0 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -71.14 -23.03 62.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.625 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.3 tp -70.11 -48.79 56.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.092 175.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 79.7 mt -53.6 -43.29 68.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.013 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -50.57 -39.13 48.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.539 173.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 35.8 t -77.34 -50.32 13.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.443 ' CG ' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p30 -72.59 -39.66 67.18 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -174.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.494 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.0 tm? -56.88 -48.15 78.84 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 171.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.781 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -52.12 -26.48 11.35 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 171.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 5.2 mm-40 -79.08 -34.91 43.21 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.525 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.875 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 10.3 mp -80.22 -32.09 38.51 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.857 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.781 HG12 ' HA ' ' A' ' 996' ' ' ALA . 44.3 pt -68.94 -20.42 24.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.779 175.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 1.6 p30 -95.99 -17.37 21.05 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.875 ' HB3' ' HA ' ' A' ' 998' ' ' LEU . 37.2 tptt -65.86 -40.77 91.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.152 0.501 . . . . 0.0 109.906 168.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.964 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.0 ptt? -78.29 -34.42 48.82 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.869 ' O ' ' HB2' ' A' 1007 ' ' GLN . 27.1 tttp -61.42 -56.81 16.1 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.044 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' 1004 ' ' LEU . 14.0 mt -66.4 -48.32 70.48 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.884 -172.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.77 -47.91 84.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.41 0.624 . . . . 0.0 110.481 -178.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.44 59.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.528 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.869 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.9 tp-100 -80.78 -43.14 20.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.3 0.571 . . . . 0.0 110.062 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.639 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 14.5 m-85 -106.18 24.07 13.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.375 -178.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.48 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 3.3 p -52.95 85.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 121.995 0.903 . . . . 0.0 110.829 173.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.591 ' H ' ' HB2' ' A' 1014 ' ' GLN . 16.2 tpt -152.68 105.97 3.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.48 -177.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 40.0 p 39.54 -110.1 0.09 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 124.426 1.079 . . . . 0.0 113.884 172.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 6.1 m -92.7 -22.22 19.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.511 -172.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.81 -29.8 64.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.052 0.454 . . . . 0.0 110.116 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.591 ' HB2' ' H ' ' A' 1010 ' ' MET . 0.4 OUTLIER -57.99 -48.89 78.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.221 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.78 -34.71 59.94 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' 1017 ' ' TYR . 0.4 OUTLIER -49.49 -59.56 3.64 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.52 1.152 . . . . 0.0 110.236 171.43 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HD2' ' A' 1008 ' ' TYR . 86.8 m-85 -69.04 -29.95 68.21 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.031 -1.895 . . . . 0.0 110.928 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.504 ' HE3' HD11 ' A' ' 943' ' ' ILE . 81.4 tttt -58.15 -46.91 84.86 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.253 165.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -76.72 -59.59 2.71 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.046 0.451 . . . . 0.0 112.058 -172.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -57.81 -46.31 84.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.19 -176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.705 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 20.4 mmt -74.73 -17.66 60.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.344 -177.204 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' 1018 ' ' LYS . 34.6 tp -70.92 -30.87 67.32 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 22.4 m -65.39 -38.66 90.67 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.664 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -67.35 -36.62 81.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.351 174.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.758 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -63.9 -34.84 78.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.869 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.459 ' O ' HG23 ' A' 1030 ' ' VAL . 40.2 t-80 -68.47 -31.32 70.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.719 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -61.28 -54.49 43.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 998' ' ' LEU . 0.3 OUTLIER -56.21 -48.35 76.6 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.049 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.53 ' N ' HD23 ' A' 1028 ' ' LEU . . . -54.2 -33.11 57.44 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.466 ' O ' ' HB3' ' A' 1033 ' ' LYS . 85.1 t -84.13 -38.61 14.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.994 0.426 . . . . 0.0 111.027 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.536 ' OD1' HD21 ' A' ' 990' ' ' LEU . 66.2 m-20 -72.7 -29.32 63.28 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.983 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.512 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -52.62 -55.2 24.07 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 161.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.653 ' O ' ' HB3' ' A' 1036 ' ' LEU . 5.0 tmmm? -52.31 -29.45 23.45 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 172.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' 1038 ' ' VAL . 2.4 t-20 -68.13 -48.32 65.72 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.41 -0.806 . . . . 0.0 109.193 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.812 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 10.3 tp -64.18 -32.49 74.08 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.88 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.964 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.0 tm? -48.65 -32.15 7.82 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.88 0.872 . . . . 0.0 109.781 173.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' 1041 ' ' GLN . 22.3 t70 -92.74 -35.96 13.17 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.821 178.004 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.04 HG13 ' HB3' ' A' ' 983' ' ' GLU . 38.1 t -55.92 -62.21 0.9 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.215 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1039 ' ' ILE . . . . . 1.04 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -75.94 -33.33 25.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.923 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.843 ' H ' HD12 ' A' 1039 ' ' ILE . 26.5 t70 -54.76 -31.37 58.55 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.47 162.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.821 ' HB3' ' HE2' ' A' 1045 ' ' LYS . 50.5 mt-30 -77.5 -33.76 54.32 Favored 'General case' 0 C--O 1.206 -1.232 0 C-N-CA 118.964 -1.094 . . . . 0.0 108.25 171.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.634 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.86 -53.07 60.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.571 0.544 . . . . 0.0 110.679 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.93 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.76 -42.79 17.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.404 172.072 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.486 ' N ' ' HD3' ' A' 1043 ' ' ARG . 60.3 tp -79.4 -28.94 41.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.644 0.259 . . . . 0.0 111.398 177.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.821 ' HE2' ' HB3' ' A' 1041 ' ' GLN . 73.0 mmtt -60.31 -43.85 95.97 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.859 0.838 . . . . 0.0 109.267 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.617 ' HG2' ' HD2' ' A' 1052 ' ' PRO . 18.8 ttt -62.99 -36.33 83.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.347 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.875 HD11 ' HB2' ' A' ' 920' ' ' ARG . 39.3 mm -62.15 -49.96 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.509 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 39.1 t -52.35 -40.05 61.48 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.631 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.412 ' HB2' ' HB1' ' A' ' 978' ' ' ALA . 48.7 tp60 -62.76 -67.89 0.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.7 m -160.36 5.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.45 ' HD3' HD12 ' A' 1047 ' ' ILE . 8.7 tpt180 52.82 71.72 1.37 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 109.933 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.617 ' HD2' ' HG2' ' A' 1046 ' ' MET . 4.8 Cg_exo -82.02 41.84 1.2 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 123.561 2.841 . . . . 0.0 112.403 -178.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 10.9 t60 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.417 -0.802 . . . . 0.0 109.433 179.487 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.421 0.629 . . . . 0.0 111.373 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 16.8 p -112.25 19.35 17.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.097 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.45 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.44 53.97 11.98 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.505 -174.227 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.62 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 29.8 t70 -47.33 -175.31 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 O-C-N 125.834 1.959 . . . . 0.0 112.268 -173.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.467 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.6 tmtp? -35.51 -24.09 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 124.294 1.038 . . . . 0.0 112.024 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.821 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.1 m -59.23 -52.41 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.297 175.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -76.96 -21.27 55.01 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 122.122 0.963 . . . . 0.0 108.975 -177.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 35.7 mt-10 -79.31 -54.59 5.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.087 -174.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.425 ' OD1' ' HE2' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.63 -32.54 68.08 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.812 -177.704 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 1.003 HG11 ' HA ' ' A' 1036 ' ' LEU . 9.8 p -63.71 -38.34 82.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.476 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.547 ' CG2' HD12 ' A' 1036 ' ' LEU . 7.7 p -70.17 -28.3 65.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.4 -30.59 65.01 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.335 171.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.997 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.2 tt -68.08 -48.73 64.74 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 937' ' ' ILE . 36.0 t -57.51 -44.63 85.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 110.343 174.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 0.0 OUTLIER -59.04 -32.18 69.52 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.043 176.598 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.7 -26.63 40.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.583 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.632 ' O ' ' HB3' ' A' ' 939' ' ' MET . 14.7 p -83.49 -12.56 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.035 171.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 933' ' ' VAL . 46.0 mm -73.83 -39.07 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 164.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.6 mm-40 -52.57 -33.8 47.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.314 169.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.97 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 32.5 ttm -60.03 -45.82 91.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.974 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.569 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 48.8 m -68.25 -30.05 69.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.173 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.697 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.6 m -76.49 -33.8 58.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.824 0.821 . . . . 0.0 109.008 -177.191 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.621 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 19.5 mmtt -60.09 -50.47 73.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.195 -1.366 . . . . 0.0 112.28 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.401 HD13 ' CE1' ' A' ' 951' ' ' TYR . 6.8 tp -69.67 -23.69 26.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.049 -176.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.733 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.9 mt-30 -52.68 -61.73 4.28 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.733 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 73.6 Cg_endo -99.62 10.0 0.72 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.783 1.656 . . . . 0.0 115.148 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.629 ' HB3' ' HG2' ' A' ' 950' ' ' GLU . . . -139.24 159.67 65.34 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 118.885 0.766 . . . . 0.0 112.844 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.7 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 1.5 Cg_endo -83.5 173.92 9.25 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.859 3.039 . . . . 0.0 111.569 174.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 91.4 Cg_exo -48.4 -16.29 0.66 Allowed 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 124.264 3.309 . . . . 0.0 115.277 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -54.43 -18.5 4.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.21 169.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.7 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.0 OUTLIER -95.4 -15.42 23.04 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.655 175.189 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 948' ' ' PRO . 5.8 m-30 -49.38 -44.14 44.69 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.566 0.698 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.125 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.1 OUTLIER -69.84 -56.66 7.31 Favored Pre-proline 0 CA--C 1.555 1.169 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.134 177.617 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.974 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.5 Cg_exo -55.71 -35.08 92.61 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.509 2.139 . . . . 0.0 114.964 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.97 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 24.6 ptt? -65.41 -42.18 92.83 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.798 -0.563 . . . . 0.0 110.091 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.676 HG13 ' HG ' ' A' ' 998' ' ' LEU . 74.7 t -67.41 -28.6 42.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.996 170.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.5 tmpt? -60.29 -40.15 89.44 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 33.5 mm-40 -54.37 -45.97 72.93 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.423 174.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 1.8 t -75.73 -29.6 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.19 -44.09 77.5 Favored Glycine 0 N--CA 1.455 -0.09 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.829 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.478 HD22 ' HE3' ' A' ' 956' ' ' LYS . 11.0 mp -64.52 -21.29 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 110.574 171.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.2 -53.05 59.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.565 177.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.698 ' HB3' HD22 ' A' ' 995' ' ' LEU . 2.7 tm? -72.51 -28.8 63.1 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.121 177.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.411 ' HB2' ' HA ' ' A' ' 960' ' ' LEU . 60.0 mtp180 -54.69 -59.59 4.51 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.756 -0.59 . . . . 0.0 111.717 170.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 17.2 p -55.87 -37.73 69.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.235 0.54 . . . . 0.0 110.559 175.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' 1035 ' ' LEU . 23.8 tp -65.85 -27.88 68.56 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.994 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 49.3 tp -64.71 -34.45 78.34 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.65 90.71 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.576 0.703 . . . . 0.0 109.714 173.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.821 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 4.1 m -66.97 -39.68 87.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.04 173.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.654 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 70.8 t -54.62 -37.24 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.497 174.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 35.0 t70 -71.8 -22.77 61.52 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 20.3 mm-40 -65.74 -52.93 47.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 123.187 1.47 . . . . 0.0 108.06 168.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.559 ' OG ' HG21 ' A' ' 980' ' ' THR . 42.3 t -66.06 -25.43 67.03 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.291 -1.777 . . . . 0.0 111.855 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 969' ' ' VAL . 53.7 mt -61.35 -51.01 80.88 Favored Pre-proline 0 C--O 1.214 -0.798 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.921 -177.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.564 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 57.2 Cg_exo -56.64 -30.05 82.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 121.567 1.595 . . . . 0.0 111.075 168.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 3.2 t -75.6 -13.36 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.827 176.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.668 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 4.9 tt -64.35 -55.47 30.36 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.564 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 51.9 Cg_exo -56.72 -32.26 90.52 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.61 1.54 . . . . 0.0 111.37 174.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.18 -65.05 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.012 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.1 m -157.99 -36.76 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.793 HG22 ' HB ' ' A' ' 984' ' ' ILE . 4.9 m -55.43 -18.48 7.04 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -174.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.668 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 16.1 p-80 -48.78 -20.19 0.45 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 79.7 mtt180 -78.11 -55.39 5.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.077 0.942 . . . . 0.0 110.154 175.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.853 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.71 -45.77 23.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.389 -175.023 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.793 ' HB ' HG22 ' A' ' 980' ' ' THR . 8.7 tp -56.78 -34.05 42.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.469 -172.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 0.0 OUTLIER -74.45 -34.5 63.19 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.165 179.279 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.0 ptp -60.75 -56.4 21.69 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 119.958 -0.697 . . . . 0.0 112.294 -174.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.575 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.62 -33.71 41.23 Favored 'General case' 0 C--O 1.209 -1.042 0 O-C-N 122.262 -0.274 . . . . 0.0 110.973 -176.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 1.092 ' HA ' HD12 ' A' ' 991' ' ' LEU . 48.0 tt0 -61.12 -46.09 92.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.099 0.475 . . . . 0.0 110.889 -176.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 989' ' ' LYS . 9.2 mmmm -62.6 -31.48 72.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.71 175.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.688 ' HG ' ' OD1' ' A' 1031 ' ' ASP . 5.7 tp -75.19 -32.9 61.35 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.653 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.092 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.2 mt -63.58 -48.44 77.39 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.199 0.523 . . . . 0.0 110.053 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -58.06 -38.27 75.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.451 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 4.6 t -60.75 -49.86 75.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.059 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.02 -27.82 10.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.678 -0.809 . . . . 0.0 113.103 -165.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.924 ' HA ' HD22 ' A' 1028 ' ' LEU . 5.7 tp -56.86 -48.03 79.06 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 167.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.412 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -58.09 -46.66 85.12 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.513 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.692 ' O ' ' HG2' ' A' 1001 ' ' LYS . 10.3 mm-40 -62.81 -36.65 83.87 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.241 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.676 ' HG ' HG13 ' A' ' 955' ' ' VAL . 47.0 tp -66.82 -33.4 75.53 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 995' ' ' LEU . 75.9 mt -61.53 -35.97 70.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.897 175.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.664 ' O ' ' HB2' ' A' 1004 ' ' LEU . 49.1 m-80 -89.22 -6.61 56.73 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.526 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 67.1 mmtt -86.58 -36.33 18.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 174.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.125 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -70.87 -38.12 73.09 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.458 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.799 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.0 tttm -60.37 -54.24 47.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.224 -1.353 . . . . 0.0 108.889 172.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.741 ' HG ' ' CD2' ' A' 1017 ' ' TYR . 14.9 tp -57.89 -48.22 80.49 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.53 90.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.336 0.589 . . . . 0.0 110.426 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.523 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pt20 -76.34 -12.12 60.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.565 0.697 . . . . 0.0 109.8 178.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.799 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -81.67 -28.08 33.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.07 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.51 11.96 13.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.63 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.609 ' HA ' ' HG2' ' A' 1014 ' ' GLN . 8.2 p -47.36 106.71 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.469 -175.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.468 ' HG2' HD12 ' A' 1013 ' ' LEU . 53.0 tpp -153.2 129.65 10.64 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.046 176.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 7.3 t -48.19 128.84 14.7 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.316 0.385 . . . . 0.0 111.441 -178.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.8 m 76.3 -46.53 0.53 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.052 176.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.468 HD12 ' HG2' ' A' 1010 ' ' MET . 93.9 mt -72.83 -26.05 61.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.709 0.29 . . . . 0.0 111.211 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.609 ' HG2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.92 -32.53 61.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.682 -179.421 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.756 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.8 tt0 -56.13 -31.03 62.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.556 -171.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -51.35 -57.34 9.17 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.214 0.531 . . . . 0.0 110.531 171.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.741 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.0 m-30 -73.81 -23.52 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.703 178.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.756 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 62.2 tttp -64.43 -44.65 90.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.24 178.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' 1015 ' ' GLN . 97.3 mttt -59.53 -56.58 20.22 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.987 0.422 . . . . 0.0 109.946 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -50.89 -40.33 56.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.531 174.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.688 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 19.6 ttt -62.43 -52.21 64.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.4 tp -61.93 -35.24 77.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 40.1 m -63.76 -34.34 77.68 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.156 0.503 . . . . 0.0 110.811 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.687 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -79.7 -39.07 32.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.337 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -59.75 -43.85 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.144 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' 1030 ' ' VAL . 56.6 t60 -59.48 -36.24 75.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.379 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.4 65.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.924 HD22 ' HA ' ' A' ' 995' ' ' LEU . 5.0 tp -73.11 -32.0 64.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 178.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.95 -49.87 75.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.17 173.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' 1026 ' ' HIS . 99.2 t -69.17 -19.95 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 121.664 0.745 . . . . 0.0 110.622 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.811 ' OD2' ' HA ' ' A' ' 991' ' ' LEU . 0.6 OUTLIER -76.65 -43.79 36.67 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.031 177.25 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.626 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -57.13 -42.15 80.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -63.93 -33.94 76.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.975 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' 1038 ' ' VAL . 2.7 t-20 -67.38 -43.69 80.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 991' ' ' LEU . 16.3 tp -75.7 -24.39 56.24 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1036 ' ' LEU . . . . . 1.003 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -63.2 -32.67 74.12 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 120.876 0.369 . . . . 0.0 110.427 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.576 ' N ' HD23 ' A' 1036 ' ' LEU . 32.2 t70 -86.7 -36.9 18.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.853 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 25.4 t -52.82 -63.15 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.354 176.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.891 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.4 pt -81.54 -28.63 10.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.188 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -51.7 -48.41 63.55 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 163.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' 1045 ' ' LYS . 41.8 mt-30 -71.75 -25.94 62.25 Favored 'General case' 0 C--O 1.203 -1.35 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.224 177.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.628 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.7 -54.68 30.18 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 118.177 0.444 . . . . 0.0 110.969 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.62 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 2.0 mpt_? -55.35 -32.96 62.98 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.138 174.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.506 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 55.2 tp -72.61 -37.05 68.21 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.874 174.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 68.5 mmtt -58.88 -33.44 70.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.461 ' O ' ' HB3' ' A' 1050 ' ' SER . 27.1 ttt -73.07 -37.16 66.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.576 -178.063 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' 1043 ' ' ARG . 51.4 mm -61.16 -45.77 97.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.2 t -56.47 -60.25 3.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.243 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -87.47 -55.52 3.76 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -174.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' 1046 ' ' MET . 21.4 t -66.85 -44.3 81.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.946 -173.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 63.05 106.64 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-O 121.394 0.616 . . . . 0.0 111.382 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -82.18 35.36 0.58 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.258 2.639 . . . . 0.0 113.517 -173.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 47.3 t60 . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.462 -0.78 . . . . 0.0 109.923 -179.485 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.635 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 36.0 m -86.91 26.45 1.14 Allowed 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.997 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.635 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.6 62.17 2.3 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.11 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.649 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 6.5 t0 -46.01 -176.17 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 125.733 1.895 . . . . 0.0 112.702 -173.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.8 tmtp? -36.59 -24.82 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 124.236 1.014 . . . . 0.0 111.914 177.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.883 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.1 m -58.63 -52.3 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.104 175.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 64.1 t80 -75.92 -24.66 55.56 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -176.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 31.1 mt-10 -70.51 -55.9 7.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.544 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.537 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 0.2 OUTLIER -73.77 -32.89 64.01 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.468 -176.586 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.961 HG11 ' HA ' ' A' 1036 ' ' LEU . 5.5 p -62.84 -35.83 72.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.294 176.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.669 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 6.5 p -72.43 -32.71 66.54 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.79 -31.28 67.47 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.35 172.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.649 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 2.8 tp -62.0 -46.79 87.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.551 ' O ' HG22 ' A' ' 936' ' ' VAL . 61.3 t -62.8 -37.78 80.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.907 0.384 . . . . 0.0 110.442 174.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.4 mmpt? -62.47 -31.97 72.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.388 0.613 . . . . 0.0 109.784 176.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.688 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -81.61 -24.6 36.31 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.561 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.744 ' O ' ' HG2' ' A' ' 939' ' ' MET . 1.6 m -79.61 -10.76 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 C-N-CA 119.211 -0.996 . . . . 0.0 109.358 172.097 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.531 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 67.0 mt -73.86 -30.54 28.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 167.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.6 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 7.5 mm-40 -55.21 -47.42 75.32 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.001 170.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.744 ' HG2' ' O ' ' A' ' 936' ' ' VAL . 11.5 ptt? -62.19 -40.6 96.6 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.283 0.364 . . . . 0.0 110.604 -175.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.5 p -68.9 -31.55 70.54 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.568 0.223 . . . . 0.0 111.27 -178.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.713 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.8 m -80.08 -42.75 23.05 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.5 tppp? -59.67 -39.34 84.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 113.268 -1.787 . . . . 0.0 111.479 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.785 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -73.64 -31.98 33.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 121.321 -0.152 . . . . 0.0 110.975 -179.455 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.1 mt-30 -49.91 -61.84 3.2 Favored Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.713 ' HD3' ' O ' ' A' ' 941' ' ' SER . 93.7 Cg_endo -99.12 16.1 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.09 1.86 . . . . 0.0 113.42 -172.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -116.39 151.84 47.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 5.4 Cg_exo -80.91 -179.63 5.26 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.766 2.978 . . . . 0.0 110.516 170.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 10.2 Cg_endo -53.41 -24.88 29.45 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.804 2.336 . . . . 0.0 113.063 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.461 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 36.3 mt-10 -57.17 -44.11 83.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.718 178.113 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.952 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.9 mp0 -94.03 1.09 56.27 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.569 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.628 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.6 m-85 -58.12 -45.56 87.07 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 170.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.089 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -72.33 -47.01 10.54 Favored Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 119.502 -0.879 . . . . 0.0 112.293 176.127 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.089 ' HD3' HG13 ' A' ' 952' ' ' VAL . 80.4 Cg_exo -51.47 -30.78 36.41 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 122.093 1.862 . . . . 0.0 115.108 171.262 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.785 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 2.4 ptt? -64.62 -46.02 84.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.95 -1.1 . . . . 0.0 108.653 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.673 ' N ' ' HG3' ' A' ' 954' ' ' MET . 0.3 OUTLIER -64.33 -25.06 37.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.777 173.827 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.4 ttmm -61.85 -37.59 85.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 176.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -59.35 -46.73 87.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.863 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 936' ' ' VAL . 9.0 m -65.5 -28.16 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.605 176.251 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.82 64.47 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.179 -1.01 . . . . 0.0 111.921 178.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.38 -36.63 71.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.95 0.405 . . . . 0.0 110.24 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.688 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -56.9 -56.04 26.73 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.792 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.532 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 30.6 tp -63.08 -35.5 80.47 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.649 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 52.1 mtm-85 -62.73 -48.95 77.02 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.272 176.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.508 HG22 ' OD1' ' A' ' 928' ' ' ASN . 5.5 m -56.08 -39.05 71.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.773 0.797 . . . . 0.0 109.792 172.185 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.592 HD22 HD22 ' A' ' 932' ' ' LEU . 64.8 tp -62.48 -27.66 69.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.974 176.035 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 86.1 mt -64.77 -28.94 69.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.331 178.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.84 -40.93 97.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.249 0.547 . . . . 0.0 109.713 172.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.755 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.5 m -61.46 -43.74 98.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.57 172.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.554 HG13 HD11 ' A' ' 984' ' ' ILE . 91.2 t -54.88 -31.42 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.157 177.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.9 t70 -75.78 -26.3 57.21 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.571 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 57.1 mm-40 -70.66 -49.15 50.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 122.709 1.242 . . . . 0.0 108.92 171.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.626 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.3 t -68.28 -24.69 64.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.67 -1.604 . . . . 0.0 111.649 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 3.8 tt -61.43 -51.45 77.38 Favored Pre-proline 0 C--O 1.218 -0.591 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.614 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.4 Cg_exo -59.82 -27.35 84.73 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 121.09 1.425 . . . . 0.0 111.214 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.7 t -78.24 -11.8 13.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.318 175.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.864 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.8 tt -65.64 -54.86 26.98 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.207 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.572 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 28.3 Cg_endo -64.84 -23.53 62.28 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.302 1.334 . . . . 0.0 111.186 174.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.94 -60.38 3.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.375 172.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.3 m -165.35 -34.43 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -177.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.827 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.0 m -55.83 -19.91 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -172.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.864 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 11.7 p-80 -49.74 -21.15 0.99 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.891 0.701 . . . . 0.0 112.891 -173.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -73.98 -52.96 11.14 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.672 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.035 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.75 -43.38 30.99 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.202 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.827 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -58.27 -34.75 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -173.316 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -73.81 -32.4 63.72 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.657 175.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.511 ' HE1' ' HG3' ' A' ' 983' ' ' GLU . 12.0 ptt? -69.14 -54.44 14.89 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.564 -175.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.679 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.08 -33.92 38.45 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 991' ' ' LEU . 53.3 tp60 -59.37 -46.42 88.69 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.258 0.481 . . . . 0.0 111.049 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -67.76 -25.69 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.505 0.669 . . . . 0.0 109.965 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 1.7 tp -73.25 -42.33 62.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.305 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.992 HD12 ' HA ' ' A' ' 988' ' ' GLN . 10.3 mt -58.57 -49.15 78.48 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 121.365 0.602 . . . . 0.0 109.897 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.452 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 10.2 t30 -55.73 -41.08 73.35 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.545 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.6 t -69.48 -43.09 73.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.61 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 35.7 m-20 -95.63 -41.0 9.12 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.195 -0.602 . . . . 0.0 112.383 -169.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.042 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.38 -53.13 61.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 175.317 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 992' ' ' ASN . . . -60.6 -48.58 81.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.439 -177.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.0 pt-20 -64.34 -32.02 73.45 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 118.949 -1.1 . . . . 0.0 111.414 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.725 HD23 HD13 ' A' 1028 ' ' LEU . 54.9 tp -64.48 -38.27 90.43 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.852 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.549 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 76.8 mt -55.59 -39.22 53.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.401 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.694 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 33.8 m-80 -95.49 -5.27 43.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.004 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 15.8 tptp -83.35 -44.39 14.91 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.477 ' SD ' ' HB3' ' A' ' 951' ' ' TYR . 40.0 tpp -78.51 -31.14 47.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.947 173.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.761 ' O ' ' HB2' ' A' 1007 ' ' GLN . 83.3 tttt -58.34 -49.21 77.99 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 171.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1004 ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.33 -37.29 82.73 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.43 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -67.63 -44.8 77.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.381 0.61 . . . . 0.0 110.69 178.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.7 pp0? -74.26 -9.72 58.89 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.761 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp60 -91.53 -10.5 40.48 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.124 -0.943 . . . . 0.0 109.718 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 26.1 t80 -123.82 12.19 9.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.271 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.577 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 7.1 p -58.76 95.47 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.989 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 25.4 mmt -121.6 3.77 10.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.402 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.425 ' H ' ' HB2' ' A' 1014 ' ' GLN . 60.1 m 68.28 131.27 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.426 -173.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 23.1 t 71.29 -60.61 0.51 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.048 0.539 . . . . 0.0 109.919 -174.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.7 -28.18 68.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.291 0.567 . . . . 0.0 109.578 174.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.577 ' CG ' ' HA ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -60.77 -38.65 85.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.884 177.835 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.562 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 46.5 mt-30 -67.42 -30.68 70.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.779 -175.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.58 -47.44 57.95 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.675 169.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.6 m-30 -77.42 -24.71 50.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.776 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.562 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 83.9 tttt -72.44 -37.21 68.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.754 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -66.77 -50.81 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -46.86 -40.99 14.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.271 170.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.466 ' HB3' ' O ' ' A' 1018 ' ' LYS . 14.3 tmm? -61.46 -43.15 99.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.443 177.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.6 -42.0 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.755 0.312 . . . . 0.0 111.089 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 12.5 m -63.36 -36.4 83.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.064 0.459 . . . . 0.0 110.551 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.25 -36.23 47.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.814 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.638 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.1 -31.87 73.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.628 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 61.4 t60 -72.1 -46.38 56.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.109 176.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.79 85.97 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.088 0.471 . . . . 0.0 109.981 177.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.042 HD12 ' HA ' ' A' ' 995' ' ' LEU . 2.0 tt -58.74 -51.77 68.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.557 172.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.82 65.38 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.712 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 84.5 t -66.4 -33.81 65.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 174.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.671 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.1 p30 -71.89 -41.92 67.39 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -55.81 -50.37 70.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 0.0 110.025 171.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.556 ' O ' ' HB3' ' A' 1036 ' ' LEU . 13.3 tptm -66.5 -37.17 84.49 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.921 -1.036 . . . . 0.0 112.005 -174.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.571 ' O ' HG23 ' A' 1038 ' ' VAL . 60.4 t30 -75.71 -35.11 60.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.412 -174.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.761 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 7.0 tp -77.67 -30.04 51.8 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.961 ' HA ' HG11 ' A' ' 929' ' ' VAL . 6.4 tt -48.77 -41.67 33.16 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.698 0.761 . . . . 0.0 109.538 172.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -75.71 -46.74 29.47 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.205 174.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.035 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.7 t -48.02 -58.91 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.883 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.6 pp -83.44 -30.46 8.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.737 ' H ' HD12 ' A' 1039 ' ' ILE . 5.5 t0 -56.94 -42.48 80.14 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 165.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' A' 1045 ' ' LYS . 55.0 mt-30 -75.12 -23.62 57.93 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-N 114.332 -1.304 . . . . 0.0 110.837 174.082 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.64 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.38 -55.36 29.4 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 118.818 0.735 . . . . 0.0 110.721 171.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.649 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 0.9 OUTLIER -58.66 -27.67 64.98 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.703 173.803 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.557 HD23 ' O ' ' A' 1044 ' ' LEU . 5.8 tt -75.35 -32.87 61.0 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.018 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.836 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 74.1 mmtt -61.39 -30.28 70.45 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 175.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.413 ' HG2' ' HG3' ' A' 1052 ' ' PRO . 24.5 ttt -77.23 -30.26 54.48 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.931 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.593 ' HA ' ' HA ' ' A' 1051 ' ' ARG . 48.5 mm -65.36 -46.55 90.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 169.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 52.4 m -55.67 -37.54 68.43 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.972 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -60.03 -71.15 0.14 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.341 175.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.63 ' O ' ' HG2' ' A' 1051 ' ' ARG . 18.7 m -153.66 -2.24 0.21 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.913 177.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.63 ' HG2' ' O ' ' A' 1050 ' ' SER . 5.4 ptp180 61.18 124.46 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 124.065 0.946 . . . . 0.0 110.969 -170.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 12.6 Cg_exo -68.8 148.25 70.75 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.964 2.443 . . . . 0.0 112.717 -174.271 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.245 0.835 0 CA-C-O 118.57 -0.729 . . . . 0.0 109.048 174.717 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 1.055 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 21.1 t -97.78 25.55 5.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.175 0.512 . . . . 0.0 109.728 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.11 62.33 2.72 Favored 'General case' 0 CA--C 1.498 -1.045 0 CA-C-O 122.129 0.966 . . . . 0.0 109.479 -176.399 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.512 ' O ' ' N ' ' A' ' 925' ' ' VAL . 29.4 m-20 -44.62 -171.6 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 110.77 -2.923 . . . . 0.0 113.547 -176.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.502 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 1.2 tmtm? -38.09 -17.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.883 0.873 . . . . 0.0 112.865 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 1.03 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 15.8 m -65.05 -52.97 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 O-C-N 122.155 -0.341 . . . . 0.0 111.719 177.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.526 ' N ' HG23 ' A' ' 925' ' ' VAL . 46.4 t80 -75.89 -22.3 56.27 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -174.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -74.52 -61.64 1.8 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.209 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.438 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -65.96 -31.79 72.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.806 -173.972 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.802 HG11 ' HA ' ' A' 1036 ' ' LEU . 11.0 p -65.25 -43.42 95.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.606 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 18.4 p -71.21 -25.17 62.4 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.77 -27.95 62.39 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.028 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.908 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.8 tt -65.56 -46.43 79.52 Favored 'General case' 0 CA--C 1.523 -0.065 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 172.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.1 t -58.71 -41.71 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.644 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.7 OUTLIER -65.49 -27.69 68.67 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.061 0.457 . . . . 0.0 110.972 177.596 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.599 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -81.28 -26.17 35.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.198 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.59 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -82.96 -12.49 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.638 0.733 . . . . 0.0 109.489 172.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 933' ' ' VAL . 49.4 mm -66.95 -34.6 71.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.8 mt-10 -62.18 -47.53 84.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.063 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.8 ttp -55.57 -39.74 71.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.19 176.15 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.627 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 13.3 t -61.93 -38.2 87.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.07 0.462 . . . . 0.0 110.546 178.114 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.566 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.0 m -78.24 -40.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.165 0.983 . . . . 0.0 108.597 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.697 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 5.9 tmtp? -67.86 -34.94 77.66 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.278 -177.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.561 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 0.0 OUTLIER -73.4 -28.4 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.281 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.68 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 74.5 mt-30 -49.7 -54.24 33.59 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.624 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.6 Cg_endo -99.63 21.43 0.26 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.94 1.76 . . . . 0.0 113.37 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -94.95 130.11 33.79 Favored Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -171.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 92.9 Cg_endo -85.31 -179.31 3.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.034 2.489 . . . . 0.0 108.94 158.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.745 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 73.5 Cg_exo -51.07 -33.7 44.21 Favored 'Trans proline' 0 C--O 1.241 0.647 0 C-N-CA 122.048 1.832 . . . . 0.0 112.089 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.549 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 5.0 mp0 -55.07 -42.24 72.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.244 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.64 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 29.7 mm-40 -94.86 -5.8 44.19 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.468 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.745 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 12.1 m-30 -59.82 -37.32 78.84 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.941 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -73.3 -53.47 4.71 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 120.282 -0.567 . . . . 0.0 112.054 176.464 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.941 ' HD3' HG13 ' A' ' 952' ' ' VAL . 63.6 Cg_exo -56.65 -31.57 87.78 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.033 1.822 . . . . 0.0 114.454 175.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 939' ' ' MET . 18.4 ptt? -68.42 -36.71 79.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.232 1.015 . . . . 0.0 109.592 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.969 HG11 ' HA ' ' A' ' 999' ' ' ILE . 84.3 t -71.87 -25.41 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.868 174.161 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.567 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 59.4 tttp -56.24 -39.51 72.67 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.75 -48.17 75.73 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.032 175.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.59 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.8 m -76.52 -22.82 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-O 120.944 0.402 . . . . 0.0 112.017 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.55 -42.17 64.11 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.675 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.25 -24.57 63.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.91 0.386 . . . . 0.0 110.004 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.0 -56.39 22.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.62 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.581 HD11 HD13 ' A' ' 991' ' ' LEU . 53.7 tp -72.4 -31.5 65.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.199 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.461 ' HD3' ' C ' ' A' ' 963' ' ' ARG . 3.3 tmt_? -61.54 -53.67 53.34 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.438 HG22 ' OD1' ' A' ' 928' ' ' ASN . 15.7 m -59.14 -32.34 69.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.301 0.572 . . . . 0.0 110.526 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 932' ' ' LEU . 0.5 OUTLIER -63.79 -41.67 97.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.937 177.254 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 96.6 mt -53.04 -31.22 40.22 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.317 174.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -49.61 74.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.415 0.626 . . . . 0.0 109.795 173.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.844 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -56.2 -46.23 79.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.629 170.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.474 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -53.36 -30.81 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.81 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 13.0 t70 -70.6 -33.1 70.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.325 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.8 mm-40 -60.49 -54.59 43.73 Favored 'General case' 0 C--O 1.247 0.946 0 CA-C-O 122.603 1.192 . . . . 0.0 108.46 171.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 40.0 t -55.61 -26.82 46.12 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 114.224 -1.353 . . . . 0.0 112.129 174.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 1.034 ' HA ' HD13 ' A' ' 976' ' ' LEU . 7.0 tt -57.99 -53.85 61.57 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-O 118.7 -0.666 . . . . 0.0 111.743 -174.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.644 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.8 Cg_exo -54.87 -26.99 51.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 CA-C-N 120.857 1.342 . . . . 0.0 111.25 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.737 HG13 ' HB2' ' A' 1046 ' ' MET . 3.8 t -78.3 -17.32 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 120.073 -0.651 . . . . 0.0 111.554 176.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 1.038 ' HG ' HG21 ' A' ' 984' ' ' ILE . 8.6 mp -56.86 -64.37 2.59 Favored Pre-proline 0 N--CA 1.471 0.616 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.36 173.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.724 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 15.2 Cg_endo -57.67 -30.33 88.5 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.625 1.55 . . . . 0.0 111.826 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -58.17 -57.39 13.08 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.355 174.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 979' ' ' SER . . . . . 1.063 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 59.9 m -163.3 -47.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.118 0.485 . . . . 0.0 111.463 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.726 HG22 ' HB ' ' A' ' 984' ' ' ILE . 23.8 m -48.54 -24.12 1.21 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 984' ' ' ILE . 49.8 p-80 -50.06 -32.51 15.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -66.71 -52.86 39.65 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 119.455 1.025 . . . . 0.0 111.968 176.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.744 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.2 OUTLIER -70.71 -45.54 64.76 Favored 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.338 -179.23 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 1.038 HG21 ' HG ' ' A' ' 976' ' ' LEU . 8.8 tp -57.68 -39.38 69.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.609 -175.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 11.7 pt-20 -69.98 -27.28 64.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.014 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.587 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 5.4 ptp -71.97 -46.74 56.26 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.801 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.908 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -72.48 -47.09 51.52 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.847 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.871 ' HA ' HD12 ' A' ' 991' ' ' LEU . 27.2 tt0 -57.59 -45.69 84.95 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -175.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -65.22 -35.08 79.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.441 0.639 . . . . 0.0 109.315 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.77 -35.6 78.99 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.682 177.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 988' ' ' GLN . 15.6 mt -61.3 -57.47 12.2 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.316 0.579 . . . . 0.0 109.671 175.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -45.8 -43.0 12.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.053 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 17.1 p -76.26 -46.55 27.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -178.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.538 ' HB2' ' HB3' ' A' 1031 ' ' ASP . 1.0 OUTLIER -82.65 -37.32 25.05 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -169.516 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.704 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -58.61 -47.0 85.83 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 168.443 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.826 ' HA ' HG22 ' A' ' 999' ' ' ILE . . . -52.7 -28.38 21.66 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 993' ' ' SER . 77.1 mt-10 -77.13 -34.08 56.67 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 118.575 -1.25 . . . . 0.0 108.693 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.666 HD23 HD13 ' A' 1028 ' ' LEU . 18.6 tp -78.23 -29.03 48.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.969 ' HA ' HG11 ' A' ' 955' ' ' VAL . 5.8 tt -77.21 -0.74 3.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-O 121.908 0.861 . . . . 0.0 108.827 172.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.695 ' HA ' ' HB2' ' A' 1003 ' ' LYS . 6.8 m-80 -102.78 -6.36 22.67 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.62 170.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1001 ' ' LYS . . . . . 1.01 ' HD3' ' HB2' ' A' 1021 ' ' MET . 42.3 tptt -73.12 -36.8 66.78 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 162.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.745 ' HB2' ' HB ' ' A' ' 955' ' ' VAL . 24.2 ttm -64.77 -60.96 2.49 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.42 -1.264 . . . . 0.0 108.626 171.412 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.779 ' O ' ' HB2' ' A' 1007 ' ' GLN . 45.3 mttp -65.17 -57.11 9.38 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.241 -174.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.665 HD23 ' HB3' ' A' 1017 ' ' TYR . 8.4 tt -82.3 -31.31 30.06 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -163.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.532 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -71.33 -43.19 67.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.075 178.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -76.79 -26.28 54.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.458 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.779 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.9 tp-100 -53.83 -52.96 58.68 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.828 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.629 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 28.1 m-85 -92.18 -53.83 4.08 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.851 -175.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.514 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 11.3 p 40.63 45.51 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 122.16 0.981 . . . . 0.0 111.887 -176.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 17.9 mmt -88.77 90.61 8.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.517 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 44.4 p 40.91 -99.77 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 174.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 62.4 p -94.85 -28.18 15.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.892 0.377 . . . . 0.0 111.026 -176.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.58 -13.15 62.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.066 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.736 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 1.0 OUTLIER -57.91 -35.01 70.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.398 175.604 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.415 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 2.6 mp0 -59.88 -22.41 62.31 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.213 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -53.99 -59.54 4.5 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 167.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.736 ' CD2' ' HA ' ' A' 1014 ' ' GLN . 0.3 OUTLIER -61.55 -20.43 63.25 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.725 ' O ' ' HB3' ' A' 1021 ' ' MET . 39.5 ttmt -79.35 -43.46 23.48 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.301 171.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -68.04 -41.88 81.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.397 0.618 . . . . 0.0 109.343 177.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -56.23 -31.46 63.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.696 173.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1021 ' ' MET . . . . . 1.01 ' HB2' ' HD3' ' A' 1001 ' ' LYS . 43.5 ttp -56.49 -44.73 80.93 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 173.369 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.69 -43.05 76.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.595 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.1 m -71.38 -46.57 59.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.714 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.94 76.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.713 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -64.26 -36.35 83.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 110.491 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.594 ' O ' HG23 ' A' 1030 ' ' VAL . 14.1 t-80 -66.94 -42.25 85.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.16 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.53 -47.54 85.09 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.477 0.485 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.9 OUTLIER -65.41 -42.26 92.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.588 0.709 . . . . 0.0 110.233 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.61 -28.95 61.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.907 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' 1026 ' ' HIS . 74.2 t -74.29 -47.69 39.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.122 177.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.704 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -59.74 -42.36 92.99 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.694 179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -62.83 -49.95 72.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.982 0.42 . . . . 0.0 110.436 175.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.731 ' HA ' HD23 ' A' 1036 ' ' LEU . 87.6 tttt -59.81 -38.51 82.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.706 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.533 ' O ' HG23 ' A' 1038 ' ' VAL . 17.1 t-20 -72.4 -53.72 11.43 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.315 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 991' ' ' LEU . 29.0 tp -56.5 -33.96 66.5 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.141 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.802 ' HA ' HG11 ' A' ' 929' ' ' VAL . 1.8 pp -61.79 -38.67 88.92 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.809 0.731 . . . . 0.0 109.396 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.0 t70 -66.97 -40.07 87.36 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.181 174.225 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.908 HG21 ' HB2' ' A' ' 987' ' ' ALA . 76.7 t -60.87 -68.44 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.653 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1039 ' ' ILE . . . . . 1.03 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -70.07 -33.75 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -173.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.74 ' H ' HD12 ' A' 1039 ' ' ILE . 6.9 t70 -48.81 -45.18 40.04 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 122.43 1.109 . . . . 0.0 108.372 166.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' A' 1045 ' ' LYS . 82.1 mm-40 -79.11 -24.84 43.13 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 113.487 -1.688 . . . . 0.0 111.134 177.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.01 -55.02 31.15 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.526 173.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1043 ' ' ARG . . . . . 1.055 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 21.8 mmm180 -57.86 -32.97 68.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.829 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.634 HD12 ' HB ' ' A' 1047 ' ' ILE . 60.3 tp -77.99 -26.33 48.55 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 121.113 -0.235 . . . . 0.0 111.235 175.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1045 ' ' LYS . . . . . 1.063 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 46.7 mmtm -57.08 -44.45 83.11 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.664 0.745 . . . . 0.0 109.536 171.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.737 ' HB2' HG13 ' A' ' 975' ' ' VAL . 26.9 ttt -65.62 -38.93 90.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.66 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.634 ' HB ' HD12 ' A' 1044 ' ' LEU . 49.7 mm -66.87 -35.81 75.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.894 175.254 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 36.9 t -60.55 -53.85 52.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.91 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -69.99 -44.2 69.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.046 0.451 . . . . 0.0 110.911 -178.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 46.2 m -94.36 22.87 5.61 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.388 -175.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.71 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 62.3 ttt180 -59.88 -50.73 85.14 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.535 176.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.71 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 11.4 Cg_exo -72.28 -75.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.601 1.534 . . . . 0.0 110.939 171.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 38.6 p-80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.562 177.687 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.938 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 20.3 tpt180 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 67.5 m 71.27 105.37 0.06 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -160.32 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.687 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -53.53 85.44 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -166.884 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 922' ' ' ASN . 1.9 t70 -47.16 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 112.785 -2.007 . . . . 0.0 113.238 -174.307 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.9 tmtp? -41.82 -23.15 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.428 -178.534 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.823 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 1.9 m -56.41 -54.86 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 118.745 -0.645 . . . . 0.0 112.048 172.716 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.687 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 20.2 t80 -74.37 -34.91 63.5 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 118.843 -1.143 . . . . 0.0 107.934 -175.133 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 11.8 mm-40 -58.68 -57.27 13.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.113 -1.858 . . . . 0.0 112.877 -176.47 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.463 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 3.1 t-20 -73.72 -35.26 65.08 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.905 -171.554 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.774 HG22 ' CD2' ' A' ' 965' ' ' LEU . 3.8 t -61.69 -36.03 71.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.036 -0.666 . . . . 0.0 110.235 175.012 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.568 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 42.5 m -66.5 -37.75 85.74 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 171.942 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.36 -30.37 64.58 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.691 174.3 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.564 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.42 -39.38 90.56 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 173.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG13 ' A' ' 937' ' ' ILE . 48.0 t -66.14 -40.73 87.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.607 173.256 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.5 OUTLIER -61.73 -33.69 74.49 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 178.438 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -80.63 -26.56 37.65 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.33 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.567 ' O ' ' HG2' ' A' ' 939' ' ' MET . 9.5 p -78.19 -16.44 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 119.448 -0.901 . . . . 0.0 108.877 171.639 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.617 HG13 ' O ' ' A' ' 933' ' ' VAL . 51.4 mt -67.33 -38.13 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 167.112 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.676 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 64.9 mm-40 -52.52 -38.52 59.84 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.123 172.221 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.929 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.9 ptt? -61.63 -40.57 95.34 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 t -74.24 -31.05 62.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.378 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.676 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.1 t -71.57 -52.55 17.57 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.538 0.685 . . . . 0.0 110.095 -176.273 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.53 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -80.18 -11.03 59.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.03 -173.602 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.976 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -79.65 -26.97 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.748 0.785 . . . . 0.0 109.264 173.772 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.8 mt-30 -60.97 -51.77 76.98 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.83 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.676 ' HD3' ' O ' ' A' ' 941' ' ' SER . 85.5 Cg_endo -97.3 17.57 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.459 1.439 . . . . 0.0 114.992 -176.54 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -130.65 167.47 21.07 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.411 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 6.5 Cg_endo -90.52 170.02 3.81 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 124.031 3.154 . . . . 0.0 111.776 168.954 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.555 ' C ' ' H ' ' A' ' 950' ' ' GLU . 5.4 Cg_endo -47.06 -26.68 5.31 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 124.908 3.739 . . . . 0.0 115.023 -167.028 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 8.7 mm-40 -52.5 0.7 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.921 170.349 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.976 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -106.9 -25.17 11.77 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 109.74 -0.466 . . . . 0.0 109.74 179.31 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.493 ' O ' ' HG2' ' A' ' 954' ' ' MET . 21.6 m-85 -47.02 -42.34 18.07 Favored 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 173.27 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.024 HG13 ' HD3' ' A' ' 953' ' ' PRO 0.25 0.4 OUTLIER -73.89 -58.29 2.17 Favored Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 119.028 -1.069 . . . . 0.0 113.024 178.52 . . . . . . . . 4 4 . 1 . 021 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.024 ' HD3' HG13 ' A' ' 952' ' ' VAL . 36.0 Cg_exo -64.4 -18.52 63.37 Favored 'Trans proline' 0 C--N 1.358 1.075 0 C-N-CA 121.92 1.747 . . . . 0.0 114.631 178.011 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.929 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 22.7 ptt? -70.8 -43.09 69.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 176.797 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.777 ' HB ' ' HB3' ' A' 1002 ' ' MET . 78.9 t -68.54 -27.64 37.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.664 172.329 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.4 tptm -52.32 -45.08 65.45 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 171.818 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' A' ' 954' ' ' MET . 4.7 mm-40 -56.34 -46.77 79.78 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.988 177.648 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.567 HG12 ' HA ' ' A' ' 955' ' ' VAL . 9.8 p -81.93 -22.18 9.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -178.546 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.651 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -70.46 -45.34 54.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.842 -1.17 . . . . 0.0 112.016 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.433 HD23 ' HD3' ' A' ' 963' ' ' ARG . 87.5 mt -65.92 -24.35 66.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.686 0.279 . . . . 0.0 110.443 170.642 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.8 -55.41 30.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.665 175.865 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.917 HD13 ' HB2' ' A' ' 995' ' ' LEU . 6.7 tt -66.4 -27.45 67.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.501 -0.479 . . . . 0.0 110.656 179.609 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.433 ' HD3' HD23 ' A' ' 960' ' ' LEU . 17.1 mtp180 -65.69 -48.07 73.27 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.961 -0.462 . . . . 0.0 111.287 171.037 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 22.1 m -55.99 -40.52 73.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.739 0.781 . . . . 0.0 109.68 171.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.774 ' CD2' HG22 ' A' ' 929' ' ' VAL . 1.3 tm? -59.32 -28.69 67.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.482 175.151 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 963' ' ' ARG . 0.4 OUTLIER -68.28 -25.08 64.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.993 178.982 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 971' ' ' GLU . . . -68.74 -36.96 79.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.101 171.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.779 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.1 m -64.44 -40.8 96.43 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.379 172.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.577 HG13 HD11 ' A' ' 984' ' ' ILE . 85.4 t -55.35 -32.36 29.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.2 172.091 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.523 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.6 t70 -80.06 -29.53 39.22 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.806 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.6 mm-40 -64.13 -50.22 69.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.617 1.198 . . . . 0.0 108.828 170.527 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.592 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.0 t -64.55 -23.11 67.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.306 176.312 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.657 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 60.1 tp -57.02 -52.93 70.4 Favored Pre-proline 0 C--O 1.218 -0.558 0 CA-C-O 118.713 -0.661 . . . . 0.0 112.431 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.645 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.4 Cg_exo -58.14 -27.99 82.17 Favored 'Trans proline' 0 C--N 1.357 1.024 0 CA-C-N 121.202 1.465 . . . . 0.0 111.044 169.364 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 1046 ' ' MET . 3.1 t -78.4 -8.56 11.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.508 176.605 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.998 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.6 tt -70.92 -52.79 9.4 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 118.942 -0.552 . . . . 0.0 111.077 177.347 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.576 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 32.6 Cg_endo -66.64 -18.57 53.87 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.291 1.327 . . . . 0.0 111.123 173.069 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.89 -55.72 8.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.567 171.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.6 m -171.34 -36.73 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.101 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.639 HG22 ' HB ' ' A' ' 984' ' ' ILE . 6.9 m -58.04 -17.18 16.03 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -171.008 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.998 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 5.3 p-80 -48.46 -19.59 0.34 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.811 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 -75.53 -55.19 5.91 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.874 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.001 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -79.41 -40.17 30.68 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.29 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.639 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.7 tp -54.62 -35.89 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.719 -172.764 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 9.0 pt-20 -76.33 -38.19 56.3 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.884 176.728 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.719 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 3.6 ptp -59.37 -50.74 72.79 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.832 -173.917 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.68 ' N ' ' HG3' ' A' ' 986' ' ' MET . . . -78.58 -37.4 42.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.461 -176.434 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.975 ' HA ' HD12 ' A' ' 991' ' ' LEU . 1.4 tm0? -61.86 -40.59 95.88 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.297 -177.255 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 38.6 mmtm -59.54 -40.69 88.03 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 173.663 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -68.27 -36.07 78.85 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.896 -179.168 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.975 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -59.97 -49.38 77.91 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.183 0.516 . . . . 0.0 110.33 178.583 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -54.4 -42.82 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.797 -178.184 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 63.0 m -74.69 -38.87 62.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.175 -176.786 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.536 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.0 OUTLIER -89.33 -39.59 13.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -169.784 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.917 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.5 tm? -61.08 -31.43 71.1 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 168.744 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.68 -50.0 75.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.594 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.63 -32.36 71.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.807 174.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 1.016 HD21 ' HA ' ' A' 1025 ' ' ALA . 0.2 OUTLIER -65.77 -34.52 78.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.888 0.375 . . . . 0.0 110.463 175.668 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -61.99 -35.7 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.585 0.707 . . . . 0.0 109.385 174.557 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.724 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.3 m-80 -85.46 -13.16 50.06 Favored 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.507 176.631 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.875 ' HG2' ' HB2' ' A' 1021 ' ' MET . 0.1 OUTLIER -68.76 -40.18 79.87 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.049 0.452 . . . . 0.0 110.251 175.963 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.992 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.8 ptt? -78.64 -34.17 46.66 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.817 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.724 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 81.4 tttt -73.48 -55.71 5.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.95 -177.416 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.1 mp -54.42 -45.16 72.92 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.7 84.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.176 0.512 . . . . 0.0 110.067 177.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.885 ' HG3' HG12 ' A' ' 952' ' ' VAL . 15.5 mm100 -78.69 -9.8 59.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.799 0.809 . . . . 0.0 112.09 178.52 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.591 ' HB2' ' O ' ' A' 1003 ' ' LYS . 18.1 tp60 -77.91 -43.76 29.04 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.439 175.798 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.419 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 2.9 t80 -75.49 -57.56 3.81 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.311 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.425 ' HB ' ' HA ' ' A' 1006 ' ' GLN . 9.9 p 40.09 35.93 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.871 1.268 . . . . 0.0 113.43 172.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.436 ' HG3' ' HB2' ' A' 1013 ' ' LEU . 46.2 tpp -86.11 120.79 27.86 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 175.276 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -51.04 117.55 2.62 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 20.5 m 77.49 -39.1 0.3 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.914 0.886 . . . . 0.0 111.974 178.408 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.436 ' HB2' ' HG3' ' A' 1010 ' ' MET . 8.9 mp -77.74 -8.0 57.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.158 0.504 . . . . 0.0 110.733 179.622 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.58 -25.81 40.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.68 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.9 pt20 -55.15 -33.89 63.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.196 -169.375 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -50.77 -51.12 53.43 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 111.279 173.342 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.419 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.1 m-30 -76.87 -21.61 54.7 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.512 178.309 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.495 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 38.6 ttpt -65.27 -39.82 93.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.425 177.65 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.94 -57.06 13.17 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.319 0.58 . . . . 0.0 109.885 176.185 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -48.85 -49.7 38.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.461 176.161 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.875 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 0.0 OUTLIER -73.81 -19.0 60.88 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.435 -176.759 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.55 -48.09 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.784 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.2 m -63.93 -33.76 76.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.361 177.301 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -62.93 -33.6 75.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 178.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1025 ' ' ALA . . . . . 1.016 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -69.69 -31.28 69.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 178.923 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.536 ' O ' HG23 ' A' 1030 ' ' VAL . 22.5 t-80 -64.88 -34.59 78.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.379 176.76 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.536 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -57.57 -46.94 83.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.054 175.823 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.858 HD13 ' HG ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -62.49 -46.27 89.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.88 0.847 . . . . 0.0 110.554 177.39 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.81 -36.98 68.05 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.732 -179.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' 1026 ' ' HIS . 88.6 t -65.9 -35.7 75.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 173.283 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.666 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.72 -39.21 73.52 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.108 -178.478 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.71 -53.43 56.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.073 171.89 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.597 ' O ' ' HG ' ' A' 1036 ' ' LEU . 2.9 tmtp? -60.32 -48.21 82.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.048 -174.195 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' 1038 ' ' VAL . 13.4 t-20 -64.86 -36.53 84.64 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.823 -176.016 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.884 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.98 -33.18 45.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 119.694 -0.193 . . . . 0.0 110.516 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.887 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.2 pp -67.64 -18.35 64.93 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 120.961 0.41 . . . . 0.0 109.899 -178.967 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -88.73 -38.91 14.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.222 169.771 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.001 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -50.68 -61.56 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.938 173.136 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.887 HD11 ' HA ' ' A' 1036 ' ' LEU . 1.7 pp -78.58 -24.22 13.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.125 -178.136 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.686 ' N ' HD12 ' A' 1039 ' ' ILE . 13.8 t0 -59.56 -36.18 75.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 164.809 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.8 mm-40 -72.57 -36.58 68.23 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.678 170.695 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.641 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -51.66 -53.22 41.2 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 123.223 0.327 . . . . 0.0 111.241 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.938 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 7.7 ppt_? -52.42 -38.99 60.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.699 176.009 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.638 ' N ' ' HD2' ' A' 1043 ' ' ARG . 48.2 tp -80.47 -23.42 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 121.001 -0.279 . . . . 0.0 111.29 177.487 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.774 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 28.5 mmmt -62.95 -42.68 99.89 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.668 0.747 . . . . 0.0 109.062 176.077 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.477 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.6 tmt? -61.84 -39.19 90.98 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.191 175.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 37.4 mm -61.05 -36.6 73.59 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.255 173.618 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.0 t -62.4 -21.9 65.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.869 0.366 . . . . 0.0 111.04 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -85.77 -38.62 18.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.071 178.615 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 23.5 t -83.19 -26.98 30.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 0.0 110.345 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -121.53 89.01 46.99 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.165 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.43 -23.39 5.06 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.538 2.159 . . . . 0.0 112.654 -179.258 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 56.1 p-80 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.404 -0.807 . . . . 0.0 109.909 179.232 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.767 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 20.5 tpt180 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 18.3 m 70.88 5.57 5.51 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 123.073 0.549 . . . . 0.0 110.646 -177.456 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.5 OUTLIER 55.67 78.15 0.2 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.317 171.981 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.514 ' CG ' ' HG3' ' A' 1043 ' ' ARG . 2.4 p30 -55.03 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 112.356 -2.202 . . . . 0.0 112.257 -176.006 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.559 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 3.4 tmtp? -25.38 -25.24 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.238 1.415 . . . . 0.0 114.384 177.092 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.845 HG21 ' HG2' ' A' 1043 ' ' ARG . 13.4 m -62.79 -52.79 55.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 174.263 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.522 ' N ' HG23 ' A' ' 925' ' ' VAL . 60.9 t80 -77.59 -31.17 52.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.163 0.982 . . . . 0.0 108.586 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 930' ' ' THR . 39.8 mt-10 -68.0 -49.77 59.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.931 -179.407 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.559 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 41.3 t30 -73.96 -30.33 62.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.693 HG22 HD11 ' A' ' 965' ' ' LEU . 45.2 t -64.75 -42.39 94.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.811 173.25 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.714 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.7 m -50.57 -29.4 10.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.204 0.526 . . . . 0.0 110.007 165.397 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 931' ' ' GLY . . . . . 0.407 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -70.77 -27.97 71.52 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.822 178.125 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.766 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.2 tt -64.61 -45.58 86.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.033 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.683 ' O ' HG12 ' A' ' 937' ' ' ILE . 35.2 t -57.04 -45.69 84.05 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.726 173.214 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.714 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.9 mmpt? -56.21 -45.5 79.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.701 178.117 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -77.48 -26.08 51.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.866 -177.41 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.597 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.4 p -80.44 -15.76 12.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.466 172.895 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.683 HG12 ' O ' ' A' ' 933' ' ' VAL . 25.0 mm -69.19 -28.06 37.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.479 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.555 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 11.1 mm-40 -62.49 -47.05 85.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.256 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.493 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 24.1 ttt -57.05 -38.44 73.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.704 174.944 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.622 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 19.5 m -67.29 -40.73 86.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.127 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.5 t -76.43 -42.78 42.89 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -177.766 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 7.6 mmtm -48.45 -56.18 8.94 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 113.534 -1.666 . . . . 0.0 111.293 175.958 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.685 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.4 tt -66.61 -25.26 34.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 123.651 0.594 . . . . 0.0 112.006 -173.518 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.794 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 81.4 mm-40 -51.92 -59.54 8.01 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 119.44 -0.314 . . . . 0.0 111.777 -179.299 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.794 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.0 Cg_endo -100.64 14.9 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.631 1.554 . . . . 0.0 113.555 174.896 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.645 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -75.75 137.59 70.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -174.341 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 950' ' ' GLU . 93.3 Cg_endo -85.63 178.74 4.22 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 123.141 2.561 . . . . 0.0 109.47 160.05 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.642 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 8.5 Cg_endo -51.45 -36.66 59.64 Favored 'Trans proline' 0 C--O 1.247 0.97 0 C-N-CA 122.479 2.119 . . . . 0.0 111.943 176.572 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -59.44 -16.16 21.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.582 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.541 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . 0.8 OUTLIER -114.36 -9.49 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.558 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.725 ' O ' ' HG2' ' A' ' 954' ' ' MET . 24.4 m-85 -58.65 -41.83 86.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.584 0.706 . . . . 0.0 109.523 172.702 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -73.68 -52.04 5.01 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.374 177.236 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.2 Cg_exo -56.04 -27.46 64.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.963 1.775 . . . . 0.0 115.152 173.262 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.725 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 24.8 ptt? -68.5 -42.98 77.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.676 0.751 . . . . 0.0 109.601 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.769 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.3 t -71.32 -24.73 24.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.581 174.739 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.615 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 48.0 tttm -56.47 -43.56 79.69 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 173.469 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.449 ' HB3' ' HB2' ' A' ' 938' ' ' GLU . 4.5 mm-40 -54.05 -47.87 71.17 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.106 173.655 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.578 HG12 ' O ' ' A' ' 955' ' ' VAL . 4.5 p -69.94 -21.12 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.116 177.936 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.615 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -63.59 -41.43 99.13 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 170.575 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 41.6 tp -73.74 -10.18 59.42 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.248 0.547 . . . . 0.0 110.275 175.333 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.766 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -76.14 -56.4 4.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.468 -177.774 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.496 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 59.7 tp -76.02 -17.15 59.8 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.844 0.355 . . . . 0.0 110.43 175.399 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.787 ' HE ' ' HA ' ' A' ' 963' ' ' ARG . 0.3 OUTLIER -64.71 -65.76 0.63 Allowed 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.472 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 6.1 m -58.52 -22.09 54.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.353 175.479 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.693 HD11 HG22 ' A' ' 929' ' ' VAL . 19.8 tp -75.4 -36.81 60.8 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.771 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.5 -33.99 56.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.829 172.583 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -58.46 -49.84 75.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.179 173.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 925' ' ' VAL . 9.4 m -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.961 171.684 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.9 t -54.79 -32.02 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 122.384 -0.198 . . . . 0.0 110.715 174.869 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.476 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 10.6 t70 -69.17 -32.31 71.54 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.309 176.319 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 60.1 mm-40 -60.59 -57.86 10.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 122.294 1.045 . . . . 0.0 109.111 172.651 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.531 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.3 t -66.52 -22.69 66.17 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.341 -1.3 . . . . 0.0 112.264 -178.003 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.772 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.1 tp -61.67 -48.61 89.44 Favored Pre-proline 0 C--O 1.217 -0.644 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.082 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.727 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 31.5 Cg_exo -63.54 -26.87 69.71 Favored 'Trans proline' 0 C--N 1.356 0.933 0 CA-C-N 121.58 1.6 . . . . 0.0 110.683 167.904 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.715 HG12 ' HE2' ' A' 1045 ' ' LYS . 19.4 t -74.34 -12.63 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.545 176.556 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 0.7 OUTLIER -72.16 -54.0 6.06 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.128 177.778 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 24.4 Cg_exo -63.51 -22.61 70.93 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.392 1.395 . . . . 0.0 110.643 178.753 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -61.25 2.33 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.027 171.759 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.999 ' HB2' ' HD3' ' A' 1045 ' ' LYS . 29.0 m -161.07 -42.62 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.813 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.659 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.3 m -45.97 -21.1 0.11 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.14 1.534 . . . . 0.0 115.14 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.703 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 78.7 t60 -47.63 -36.48 10.96 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.726 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 4.9 ptp180 -61.52 -56.07 24.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.739 176.747 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.798 ' HG3' HG22 ' A' 1038 ' ' VAL . 0.6 OUTLIER -76.79 -49.33 16.13 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.141 -0.623 . . . . 0.0 112.025 -174.793 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.661 ' HA ' HG11 ' A' 1038 ' ' VAL . 11.2 tt -50.58 -42.29 21.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.376 -174.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -68.1 -30.17 69.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.982 -177.16 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.68 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.5 ptm -62.51 -57.1 12.39 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.121 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.92 -34.94 38.53 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -176.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -55.48 -52.68 62.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.951 0.405 . . . . 0.0 110.44 -177.407 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -73.16 -23.91 60.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.64 . . . . 0.0 109.854 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.645 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 18.6 tp -65.9 -51.66 56.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.718 175.861 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.77 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.4 mt -53.08 -52.1 59.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.644 175.264 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -48.09 -43.05 30.36 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.358 178.329 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 50.4 m -65.02 -50.54 65.86 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.901 -178.001 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.637 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.3 m-20 -94.86 -25.41 16.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -169.271 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.615 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.9 tm? -52.84 -55.5 22.61 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.859 0.754 . . . . 0.0 109.265 165.655 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -52.71 -41.16 63.68 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.639 173.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.83 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.5 mm-40 -58.04 -48.58 79.66 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 123.779 0.674 . . . . 0.0 109.782 178.532 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' 1025 ' ' ALA . 31.2 tp -72.32 -32.79 66.84 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.567 0.542 . . . . 0.0 110.252 -172.426 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.795 ' O ' ' HG2' ' A' 1002 ' ' MET . 37.6 mm -63.5 -56.29 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 122.678 1.227 . . . . 0.0 107.931 173.992 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.715 ' O ' ' HB2' ' A' 1004 ' ' LEU . 43.0 t30 -58.22 -13.5 5.18 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 113.825 -1.534 . . . . 0.0 112.458 172.047 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.83 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 71.5 mmtt -87.24 -40.42 14.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.223 0.919 . . . . 0.0 111.081 172.84 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.795 ' HG2' ' O ' ' A' ' 999' ' ' ILE . 12.0 ptt? -61.89 -34.67 76.45 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.543 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.742 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.6 ttmt -70.91 -57.98 4.05 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 113.844 -1.525 . . . . 0.0 108.556 172.62 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' A' 1000 ' ' ASN . 2.9 tt -48.33 -57.88 5.38 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.714 0.634 . . . . 0.0 111.589 -173.659 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.407 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -60.1 -48.37 81.99 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.078 0.466 . . . . 0.0 110.562 -175.456 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.632 ' NE2' ' HA ' ' A' ' 948' ' ' PRO . 10.7 mm100 -79.11 -15.32 58.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.112 -176.451 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.742 ' HB2' ' O ' ' A' 1003 ' ' LYS . 15.6 tp60 -87.09 -37.94 16.94 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.417 177.851 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.484 ' HD2' ' CG ' ' A' 1017 ' ' TYR . 19.7 t80 -83.31 -8.67 59.39 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.854 -176.428 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' 1006 ' ' GLN . 54.0 t -36.32 109.46 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 O-C-N 124.21 0.944 . . . . 0.0 112.89 179.357 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.504 ' HG2' HG22 ' A' 1011 ' ' THR . 24.4 ttt -100.83 -75.34 0.59 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.169 172.789 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.504 HG22 ' HG2' ' A' 1010 ' ' MET . 8.9 t 178.13 125.61 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.653 174.771 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.7 m 70.51 -49.96 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.503 0.721 . . . . 0.0 111.758 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.427 ' O ' ' HB3' ' A' 1016 ' ' GLU . 95.6 mt -65.99 -4.95 8.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.432 0.693 . . . . 0.0 111.843 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.55 ' HG2' HG22 ' A' 1009 ' ' VAL . 0.4 OUTLIER -52.04 -43.42 63.74 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -177.494 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.577 ' OE1' ' HD3' ' A' 1018 ' ' LYS . 6.0 tp-100 -51.37 -35.38 38.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.584 -177.077 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' 1019 ' ' LYS . 2.6 tp10 -56.54 -59.62 4.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.338 0.589 . . . . 0.0 111.483 171.589 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.529 ' N ' ' CD1' ' A' 1017 ' ' TYR . 0.1 OUTLIER -50.06 -39.39 41.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.711 177.466 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.577 ' HD3' ' OE1' ' A' 1015 ' ' GLN . 86.4 tttt -60.98 -31.58 71.17 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.693 -1.14 . . . . 0.0 113.136 177.244 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' 1016 ' ' GLU . 89.8 mttt -58.5 -48.98 79.01 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.639 0.733 . . . . 0.0 109.23 177.028 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -51.96 -43.05 63.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.378 177.806 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.712 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 14.1 tmm? -65.12 -48.24 74.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.798 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.81 -32.85 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 -175.379 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 30.2 m -68.88 -47.06 66.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.081 0.467 . . . . 0.0 110.202 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.732 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -64.51 -35.62 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.271 177.888 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.786 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -60.87 -42.1 97.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.131 0.491 . . . . 0.0 110.446 176.132 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.572 ' O ' HG23 ' A' 1030 ' ' VAL . 58.1 t60 -69.14 -33.16 73.01 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.138 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.37 -46.92 84.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.119 176.486 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.567 HD13 ' N ' ' A' ' 995' ' ' LEU . 17.9 tp -59.72 -47.2 86.59 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.268 0.556 . . . . 0.0 110.27 177.206 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -54.69 -32.33 59.28 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.258 174.308 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 1026 ' ' HIS . 89.9 t -72.46 -40.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 122.076 -0.39 . . . . 0.0 110.546 172.86 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.637 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 28.0 m-20 -57.7 -47.16 83.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.697 173.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' 1036 ' ' LEU . . . -52.74 -39.45 62.16 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.292 169.503 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' 1036 ' ' LEU . 35.2 tttm -71.93 -35.08 69.53 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.375 -176.609 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.593 ' O ' HG23 ' A' 1038 ' ' VAL . 2.1 t-20 -70.8 -54.51 11.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 -178.831 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.832 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 15.2 tp -64.02 -28.35 69.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.738 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' 1040 ' ' ASP . 55.1 tp -51.37 -44.35 62.08 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.685 174.03 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.61 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 19.4 t70 -91.45 -26.92 18.61 Favored 'General case' 0 C--O 1.22 -0.461 0 O-C-N 124.105 0.878 . . . . 0.0 110.692 -179.345 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.832 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 25.2 t -57.42 -57.46 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 123.12 0.568 . . . . 0.0 111.967 177.04 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.728 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.9 pt -86.92 -27.37 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.947 -178.11 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.61 ' HB3' ' HA ' ' A' 1037 ' ' ASP . 2.4 t70 -44.21 -48.38 9.32 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 157.617 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.675 ' HA ' ' HB3' ' A' 1044 ' ' LEU . 23.4 tt0 -78.23 -23.84 47.24 Favored 'General case' 0 C--O 1.192 -1.936 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.494 176.428 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.851 ' O ' ' HG3' ' A' 1045 ' ' LYS . . . -56.29 -47.36 78.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.619 0.723 . . . . 0.0 111.504 175.632 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.845 ' HG2' HG21 ' A' ' 925' ' ' VAL . 5.9 mmm180 -79.46 -23.68 42.91 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.469 -0.769 . . . . 0.0 110.917 177.11 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.0 tp -78.38 -29.2 47.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.096 0.474 . . . . 0.0 110.498 175.474 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.999 ' HD3' ' HB2' ' A' ' 979' ' ' SER . 0.1 OUTLIER -71.42 -25.7 62.44 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 176.518 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 59.7 ttp -73.89 -28.69 61.68 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.603 175.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' 1044 ' ' LEU . 45.0 mm -69.89 -32.8 53.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 168.232 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.739 ' HB2' ' O ' ' A' 1045 ' ' LYS . 44.0 m -57.56 -23.75 52.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.245 172.541 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -69.57 -53.63 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.128 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' 1051 ' ' ARG . 6.3 m -63.37 -59.69 4.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.677 179.257 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.927 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 46.2 mtp180 88.34 -88.09 0.0 OUTLIER Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.303 1.441 . . . . 0.0 112.999 179.764 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.927 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 2.8 Cg_endo -79.81 97.95 1.11 Allowed 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 121.656 1.627 . . . . 0.0 112.438 -173.579 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 17.2 t60 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.408 177.075 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.788 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 21.1 tpt180 . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 47.9 m -61.22 126.55 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 164.365 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.509 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.1 OUTLIER -64.29 84.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.529 0.681 . . . . 0.0 112.475 -170.599 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.1 t70 -47.04 -174.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.75 -174.902 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.48 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.9 tmtm? -36.03 -27.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.146 0.978 . . . . 0.0 111.96 -179.869 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.876 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 3.3 m -55.32 -53.64 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-O 119.16 -0.448 . . . . 0.0 112.049 175.19 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 23.5 t80 -75.74 -33.92 60.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.634 -174.091 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -46.36 75.53 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.585 -173.945 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.48 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 4.1 t30 -73.97 -38.99 64.01 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.677 -174.779 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.624 HG22 ' CD2' ' A' ' 965' ' ' LEU . 12.0 t -65.24 -33.62 64.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.403 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.485 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 3.9 p -72.73 -27.44 62.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 171.095 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 931' ' ' GLY . . . . . 0.427 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -60.78 -30.61 73.15 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.342 167.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.813 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -62.86 -38.2 89.89 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 174.901 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.565 ' HA ' HG12 ' A' ' 936' ' ' VAL . 70.3 t -65.27 -41.37 91.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.495 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.587 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.2 mmpt? -60.72 -33.69 73.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.013 0.435 . . . . 0.0 110.284 177.458 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.719 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -78.97 -26.21 43.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.562 -178.944 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 958' ' ' VAL . 12.9 p -82.87 -12.05 12.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.792 0.806 . . . . 0.0 109.334 171.72 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 59.2 mt -70.55 -41.26 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.092 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.648 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 56.5 mm-40 -53.74 -43.09 68.85 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.038 169.747 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.591 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 24.7 ttt -58.29 -41.15 83.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.562 177.881 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.701 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 40.6 m -67.83 -41.23 83.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.923 -179.764 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.517 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 11.8 p -76.39 -40.62 50.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -175.104 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.644 ' HB3' ' HB2' ' A' ' 954' ' ' MET . 7.8 mmtp -53.63 -49.58 67.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.126 178.829 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.586 HD12 ' HE1' ' A' ' 954' ' ' MET . 17.5 tt -71.28 -27.75 30.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.785 -173.437 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.809 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 91.9 mt-30 -56.42 -63.21 3.66 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.42 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.809 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.6 Cg_endo -97.34 -12.12 0.49 Allowed 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.451 1.434 . . . . 0.0 114.378 -175.333 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -95.86 152.28 38.92 Favored Pre-proline 0 C--N 1.323 -0.573 0 O-C-N 122.073 -0.392 . . . . 0.0 112.007 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 2.8 Cg_exo -76.89 178.7 7.29 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.584 2.856 . . . . 0.0 112.432 -178.212 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.721 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 50.0 Cg_exo -55.88 -27.32 62.37 Favored 'Trans proline' 0 C--O 1.245 0.852 0 C-N-CA 122.821 2.347 . . . . 0.0 112.561 176.233 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -55.73 -27.45 50.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.047 173.987 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.484 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.7 OUTLIER -102.03 -5.1 24.97 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.342 175.782 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.721 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 6.8 m-30 -56.45 -43.71 79.76 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.515 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.108 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -74.68 -51.8 3.87 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 119.97 -0.692 . . . . 0.0 112.159 176.689 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.86 -32.89 48.8 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.167 1.911 . . . . 0.0 113.972 173.632 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.644 ' HB2' ' HB3' ' A' ' 942' ' ' LYS . 0.0 OUTLIER -60.02 -54.91 40.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.878 0.847 . . . . 0.0 110.633 178.553 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.826 ' HB ' ' HB3' ' A' 1002 ' ' MET . 94.2 t -63.22 -26.5 41.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.151 172.539 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 19.2 tptm -65.01 -27.26 68.7 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.046 177.964 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -59.33 -46.51 88.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.308 172.057 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.856 HG21 HD23 ' A' ' 998' ' ' LEU . 2.5 m -72.29 -24.08 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.24 175.869 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.02 -43.51 57.16 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.265 -0.969 . . . . 0.0 111.141 176.521 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.88 -33.16 68.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.246 170.263 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.813 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.86 -56.48 21.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.32 179.841 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 991' ' ' LEU . 6.9 tt -71.43 -31.62 67.43 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.506 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.07 -55.51 34.04 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.815 -0.553 . . . . 0.0 111.148 171.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 m -58.78 -33.02 69.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.525 0.679 . . . . 0.0 110.339 174.471 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.647 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 1.8 tm? -63.53 -34.12 77.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.291 174.512 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 35.6 tp -62.46 -25.81 68.18 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.348 178.536 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.96 -43.05 84.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.175 0.512 . . . . 0.0 110.085 171.338 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.674 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 6.9 m -61.89 -37.44 84.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.294 173.82 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 965' ' ' LEU . 97.5 t -58.14 -31.25 41.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.115 174.457 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.47 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 22.0 t70 -76.79 -23.61 52.88 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.067 0.46 . . . . 0.0 110.824 178.405 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 63.8 mm-40 -70.52 -53.71 15.07 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.379 1.085 . . . . 0.0 108.839 169.7 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.716 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.8 t -66.95 -25.95 66.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.149 -178.479 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 57.3 tp -62.59 -53.21 59.15 Favored Pre-proline 0 C--O 1.218 -0.595 0 CA-C-O 118.863 -0.589 . . . . 0.0 112.297 -176.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.1 Cg_exo -54.86 -32.22 76.48 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 120.928 1.367 . . . . 0.0 111.297 169.193 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.8 t -77.46 -10.47 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.591 177.384 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.739 ' HG ' ' CB ' ' A' ' 981' ' ' HIS . 2.3 tt -65.59 -53.2 38.84 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.182 176.761 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.623 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 37.6 Cg_exo -61.87 -33.55 84.17 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.353 1.369 . . . . 0.0 110.842 173.985 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.96 27.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.918 175.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.844 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 8.7 m -170.73 -26.95 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -177.601 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.718 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 37.2 m -63.2 -20.92 65.86 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 -170.613 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.739 ' CB ' ' HG ' ' A' ' 976' ' ' LEU . 1.8 p80 -50.79 -21.91 1.89 Allowed 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -171.72 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -69.2 -54.5 14.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 119.883 -0.727 . . . . 0.0 110.535 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 1.018 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.99 -43.07 30.66 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.662 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.6 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.6 tp -60.23 -29.14 43.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.512 -175.031 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.37 -36.67 63.57 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.426 172.417 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.6 ptm -68.92 -52.73 26.3 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.991 -175.767 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.678 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.19 -46.22 21.05 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.487 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' A' ' 991' ' ' LEU . 23.2 tp60 -60.64 -37.56 81.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.291 -175.126 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -59.6 -41.94 91.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.737 0.78 . . . . 0.0 109.173 174.796 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 987' ' ' ALA . 0.1 OUTLIER -72.77 -35.68 67.5 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.973 179.417 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 1.034 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.0 mt -60.72 -50.13 74.71 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.626 0.727 . . . . 0.0 109.837 179.164 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -56.67 -41.87 78.01 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.235 -175.127 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 11.5 p -75.54 -33.2 60.66 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -178.248 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.09 -41.87 10.26 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -171.327 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.6 OUTLIER -59.56 -39.11 82.95 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 171.141 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -54.86 -48.93 72.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.771 178.251 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 993' ' ' SER . 62.6 mm-40 -57.61 -38.93 75.76 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.373 179.434 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.856 HD23 HG21 ' A' ' 958' ' ' VAL . 14.9 tp -70.39 -29.8 66.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.089 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.506 ' O ' ' HG2' ' A' 1002 ' ' MET . 44.4 mt -61.82 -35.75 69.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.893 173.506 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.653 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 41.9 m-80 -88.42 -5.5 58.23 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.101 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 5.2 mptp? -86.19 -34.64 20.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 174.687 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.108 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.9 ptt? -73.47 -35.95 65.77 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 171.978 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.774 ' O ' ' HB2' ' A' 1007 ' ' GLN . 87.3 tttt -62.27 -56.89 14.1 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.213 174.663 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.636 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.0 mp -64.97 -35.79 82.33 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 178.768 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -63.31 -47.36 82.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.899 0.857 . . . . 0.0 109.851 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -8.4 56.88 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.196 177.312 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.774 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.0 tp-100 -90.42 -21.18 22.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.397 178.561 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 77.9 t80 -116.26 3.76 13.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.807 -174.876 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.477 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 6.4 p -49.91 102.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.911 -178.213 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 52.4 ttp -148.5 112.75 5.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.144 177.734 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 56.0 p 46.28 -104.55 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.346 173.789 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 6.3 t -124.35 -0.88 8.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.346 0.593 . . . . 0.0 109.773 -176.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 22.8 tp -83.66 -9.37 58.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.978 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.477 ' CG ' ' HA ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -61.0 -21.86 63.98 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.48 -179.896 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' A' 1019 ' ' LYS . 27.3 pt20 -55.32 -33.9 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.561 -176.412 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.6 tt0 -50.19 -49.17 53.39 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 170.893 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1017 ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -80.04 -14.6 58.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 179.228 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.8 tttp -68.63 -36.19 78.28 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 171.017 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' 1015 ' ' GLN . 32.5 mmtp -68.67 -55.26 12.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.457 176.396 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' 1016 ' ' GLU . 49.5 mm-40 -48.37 -38.42 19.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.849 173.11 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.469 ' HB3' ' O ' ' A' 1018 ' ' LYS . 37.8 ttm -58.79 -57.47 12.86 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 176.346 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.49 -34.97 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -179.588 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 61.8 m -60.71 -40.17 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.873 177.863 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.419 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -78.69 -31.28 46.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.507 179.201 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.552 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.15 -41.12 95.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.2 176.348 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.646 ' O ' HG23 ' A' 1030 ' ' VAL . 12.8 t-80 -63.84 -40.0 95.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.949 174.177 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -65.87 -45.94 80.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.07 -179.599 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.1 -28.77 64.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.504 0.668 . . . . 0.0 110.232 178.204 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.479 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.63 -41.43 85.94 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.682 -0.636 . . . . 0.0 109.694 171.483 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' 1026 ' ' HIS . 48.1 t -59.95 -30.75 46.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.468 174.167 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.492 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -76.5 -40.93 48.76 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 109.804 178.723 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.45 -52.64 64.77 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 121.252 0.549 . . . . 0.0 110.718 175.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.59 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 19.7 pttp -65.89 -32.18 73.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -172.055 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.527 ' O ' HG23 ' A' 1038 ' ' VAL . 64.9 t30 -73.6 -35.69 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.139 179.551 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.763 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -76.33 -32.5 58.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 -178.154 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.858 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.4 pp -66.54 -23.61 66.25 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.27 -39.53 25.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.566 169.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1038 ' ' VAL . . . . . 1.018 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -53.58 -65.41 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.117 -0.947 . . . . 0.0 112.792 175.955 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.876 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -74.86 -27.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.348 -177.028 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.739 ' H ' HD12 ' A' 1039 ' ' ILE . 11.7 t70 -50.35 -45.56 55.18 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.268 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.732 ' O ' ' HG2' ' A' 1045 ' ' LYS . 47.6 mt-30 -76.75 -28.69 55.84 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.031 176.017 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.657 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.84 -55.98 19.15 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.973 0.806 . . . . 0.0 111.729 176.536 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.788 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 1.4 mpt_? -58.49 -31.37 67.8 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.924 174.433 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.1 tp -76.38 -20.91 56.7 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.848 175.261 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.844 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.2 mmtt -67.41 -32.66 73.71 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.151 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 15.5 tmm? -69.12 -37.43 78.34 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.795 176.547 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.499 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 49.2 mm -65.47 -37.77 80.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.919 172.82 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.3 m -58.07 -42.62 85.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.721 177.492 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -75.43 -44.39 44.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.852 178.594 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 12.1 m -100.16 31.15 3.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.476 -174.812 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.4 ' HG3' ' CE1' ' A' 1053 ' ' HIS . 15.6 ptp180 -53.65 139.66 49.67 Favored Pre-proline 0 C--O 1.235 0.323 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.212 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.93 119.75 7.2 Favored 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 123.211 2.607 . . . . 0.0 113.256 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.4 ' CE1' ' HG3' ' A' 1051 ' ' ARG . 42.6 m80 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.57 -0.729 . . . . 0.0 109.698 176.118 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.433 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 15.0 tpt180 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 28.1 t -85.04 84.37 7.74 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.616 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -11.61 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.065 1.746 . . . . 0.0 114.114 -175.459 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.885 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 2.2 t0 -47.22 -173.4 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 112.552 -2.113 . . . . 0.0 113.275 -174.238 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.4 tmtp? -37.25 -24.7 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.922 -1.035 . . . . 0.0 112.209 177.594 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.849 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.3 m -56.45 -52.15 56.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 122.615 0.366 . . . . 0.0 111.899 172.955 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.553 ' HD1' ' CD2' ' A' 1036 ' ' LEU . 4.8 t80 -68.88 -29.58 67.9 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -178.173 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 6.3 mm-40 -68.39 -65.55 0.68 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.092 -1.413 . . . . 0.0 113.374 -173.881 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.685 HD21 ' HB ' ' A' ' 968' ' ' THR . 22.0 p-10 -73.24 -30.73 63.67 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.503 -172.556 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.654 HG22 ' CD1' ' A' ' 965' ' ' LEU . 45.9 t -64.02 -37.15 79.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.335 177.204 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.557 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 12.2 p -73.28 -28.02 61.88 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 171.275 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 931' ' ' GLY . . . . . 0.516 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -58.52 -28.27 62.15 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 114.699 -1.137 . . . . 0.0 112.546 169.18 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.689 ' HG ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -66.02 -44.58 84.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.943 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.552 ' O ' HG12 ' A' ' 937' ' ' ILE . 66.1 t -57.81 -38.06 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.588 172.193 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 930' ' ' THR . 9.8 mmpt? -62.96 -36.12 82.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 175.738 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.666 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.94 -25.81 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.642 -179.026 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 14.5 p -81.6 -16.41 12.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.558 172.781 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 933' ' ' VAL . 47.6 mm -69.26 -37.48 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 165.935 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.2 mm-40 -53.87 -37.38 63.63 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.704 171.367 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.666 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 59.6 ttp -58.87 -45.65 89.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 31.8 m -71.87 -28.62 63.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 178.602 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.616 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.0 m -77.36 -41.17 41.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.138 0.971 . . . . 0.0 108.391 -176.48 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.8 mmtp -59.22 -42.07 90.13 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 113.532 -1.667 . . . . 0.0 111.955 179.318 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.457 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.6 tt -71.66 -24.55 23.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.065 -176.168 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.782 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 76.4 mt-30 -55.82 -62.68 4.2 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.782 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -100.49 12.25 0.52 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.749 1.633 . . . . 0.0 114.26 -176.103 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -131.47 155.24 81.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.775 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.726 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.3 Cg_endo -93.21 -169.37 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 123.886 3.058 . . . . 0.0 112.701 -177.304 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.726 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 94.7 Cg_exo -49.51 -32.8 28.4 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.282 2.655 . . . . 0.0 113.559 176.464 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.541 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 73.4 mm-40 -53.63 -20.9 5.83 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.917 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.533 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.4 OUTLIER -118.73 -6.86 10.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.565 -178.591 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.758 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.9 m-85 -55.98 -48.55 75.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.136 0.494 . . . . 0.0 109.951 175.139 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.055 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.09 -44.69 3.75 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 119.106 -1.037 . . . . 0.0 111.702 176.829 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.055 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.4 Cg_exo -55.16 -27.98 58.83 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.597 2.198 . . . . 0.0 115.462 172.28 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.758 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 18.6 ptp -69.33 -44.78 70.97 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.182 0.991 . . . . 0.0 108.764 175.853 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.776 ' CG1' ' HA ' ' A' ' 999' ' ' ILE . 59.4 t -59.91 -27.66 39.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.912 169.547 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.512 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 27.6 ttpt -66.39 -33.13 75.02 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.684 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.06 -45.46 79.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.573 175.691 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.8 m -70.51 -24.99 26.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.266 175.293 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.39 -43.79 36.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.824 177.786 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.9 -24.87 68.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.088 0.471 . . . . 0.0 109.903 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.689 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -65.57 -49.8 67.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.334 173.307 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.876 ' HB2' ' HG ' ' A' ' 995' ' ' LEU . 18.0 tp -59.83 -40.71 89.37 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 172.997 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -54.87 -55.58 28.89 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.001 0.429 . . . . 0.0 111.15 172.323 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 44.0 m -55.67 -42.44 75.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.723 0.773 . . . . 0.0 110.43 174.798 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.663 HD21 HD22 ' A' ' 991' ' ' LEU . 9.9 tp -54.53 -40.13 68.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.834 176.248 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.403 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 9.6 tt -59.85 -33.38 71.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.77 -178.645 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.68 86.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.104 0.478 . . . . 0.0 110.261 175.353 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.843 HG23 HG12 ' A' ' 925' ' ' VAL . 0.8 OUTLIER -70.65 -34.05 71.63 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.825 175.401 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 98.7 t -55.81 -30.28 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 173.943 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.6 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 24.2 t70 -80.85 -29.52 35.81 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 177.825 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.3 mm-40 -69.41 -42.82 74.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 123.114 1.435 . . . . 0.0 108.186 171.167 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 972' ' ' SER . . . . . 1.018 ' HA ' HG22 ' A' ' 975' ' ' VAL . 33.2 t -68.01 -22.73 64.97 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 113.29 -1.777 . . . . 0.0 111.673 174.515 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.5 tt -58.45 -53.46 65.91 Favored Pre-proline 0 C--O 1.213 -0.854 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.082 179.199 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 43.5 Cg_exo -59.73 -34.72 95.99 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-N 121.419 1.542 . . . . 0.0 111.911 173.178 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 1.018 HG22 ' HA ' ' A' ' 972' ' ' SER . 19.7 m -77.23 -10.12 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 118.975 -1.09 . . . . 0.0 111.306 -178.613 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.905 ' HA ' ' HB ' ' A' ' 980' ' ' THR . 3.3 pp -81.98 -40.16 0.95 Allowed Pre-proline 0 CA--C 1.537 0.479 0 CA-C-O 118.307 -0.854 . . . . 0.0 113.187 -177.208 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.477 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 44.1 Cg_endo -69.89 -27.22 26.1 Favored 'Trans proline' 0 C--N 1.36 1.177 0 CA-C-N 121.669 1.632 . . . . 0.0 109.662 172.222 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.26 9.19 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.554 172.336 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 18.4 m -167.94 -6.55 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.444 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.905 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 88.2 m -88.07 -23.24 23.79 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -169.643 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.583 ' HA ' HG22 ' A' ' 984' ' ' ILE . 19.8 t60 -50.72 -34.93 28.84 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.002 0.819 . . . . 0.0 111.435 -172.973 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -59.78 -52.95 63.26 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.738 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.717 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.1 tp10 -74.71 -47.95 28.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.92 -178.597 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.744 ' HA ' HG11 ' A' 1038 ' ' VAL . 8.4 tp -54.84 -38.77 45.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -173.261 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.427 ' OE1' ' HA ' ' A' ' 985' ' ' GLU . 5.2 mm-40 -73.13 -27.7 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.881 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.617 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 11.1 ptt? -63.5 -50.52 69.31 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.136 178.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.585 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.29 -42.63 22.73 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.745 -178.601 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.422 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -61.59 -42.34 98.72 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.028 -173.306 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' A' ' 989' ' ' LYS . 11.0 tmtt? -65.55 -41.39 93.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 175.646 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.76 -50.48 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.167 177.875 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.663 HD22 HD21 ' A' ' 965' ' ' LEU . 2.9 pp -74.55 -29.32 61.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.761 0.315 . . . . 0.0 111.441 -175.232 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.484 ' N ' HD12 ' A' ' 991' ' ' LEU . 26.7 t-20 -58.14 -43.38 87.29 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.478 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.5 m -76.34 -27.34 56.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.193 -174.249 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -103.98 -44.76 4.93 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -170.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.011 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.77 -50.18 71.14 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.157 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.603 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -57.51 -45.69 84.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.825 176.796 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.73 -35.38 77.9 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 1.2 tm? -72.3 -36.21 68.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.903 -174.124 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.776 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 28.7 pt -65.45 -27.05 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.208 0.528 . . . . 0.0 110.46 177.226 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.605 ' O ' ' HB2' ' A' 1004 ' ' LEU . 53.2 m-80 -93.35 -6.14 47.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.692 175.737 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.67 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 20.9 tptt -85.31 -46.83 10.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -175.797 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.703 ' HB3' HG21 ' A' ' 955' ' ' VAL . 56.9 tpp -79.85 -32.91 40.51 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.36 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 41.7 ttmt -55.28 -49.06 73.06 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.118 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.605 ' HB2' ' O ' ' A' 1000 ' ' ASN . 28.9 tp -53.86 -50.9 65.24 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.901 0.751 . . . . 0.0 112.293 171.288 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.465 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -58.48 -46.45 86.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.251 0.548 . . . . 0.0 110.979 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.528 ' OE1' ' HB3' ' A' ' 948' ' ' PRO . 20.6 mm-40 -77.43 -7.61 56.44 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.314 178.286 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.2 tp-100 -89.82 -9.41 49.27 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.136 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 57.1 t80 -130.79 13.61 5.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.068 -178.818 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.574 HG23 ' HG3' ' A' 1014 ' ' GLN . 6.5 p -53.47 108.99 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.45 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 13.9 tpt -147.65 154.3 40.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.153 -178.81 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 58.3 m -51.56 118.69 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.19 0.306 . . . . 0.0 110.972 179.646 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.704 ' O ' ' HG2' ' A' 1015 ' ' GLN . 40.7 t 74.38 -49.1 0.66 Allowed 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.99 0.806 . . . . 0.0 111.481 -177.818 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' 1010 ' ' MET . 3.3 mm? -64.24 -17.66 63.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.574 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.2 OUTLIER -59.16 -43.34 92.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.809 0.338 . . . . 0.0 110.146 178.308 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' 1012 ' ' SER . 13.5 pt20 -67.81 -21.82 65.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.822 -175.033 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' 1019 ' ' LYS . 25.8 tt0 -57.89 -55.63 32.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.422 0.629 . . . . 0.0 109.521 174.967 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.487 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 5.7 m-30 -74.94 -15.17 60.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.1 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.585 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 39.3 ttpt -78.19 -42.53 31.19 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.154 -0.219 . . . . 0.0 110.582 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' 1016 ' ' GLU . 17.2 ptpt -69.04 -20.86 64.13 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.615 0.721 . . . . 0.0 109.405 176.569 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.411 ' HG2' ' HE3' ' A' 1001 ' ' LYS . 34.3 tt0 -78.64 -42.74 27.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.086 177.706 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.478 ' HG3' ' HA ' ' A' 1018 ' ' LYS . 3.6 ppp? -74.91 -27.13 60.09 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.38 178.876 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.1 tp -63.56 -44.09 95.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.159 0.504 . . . . 0.0 110.21 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.1 m -65.87 -31.13 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.575 177.6 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.85 -35.16 44.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.508 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.17 -31.49 72.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.264 177.146 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.493 ' O ' HG23 ' A' 1030 ' ' VAL . 31.0 t60 -67.51 -34.05 76.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.772 174.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -75.76 -41.65 52.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.164 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.011 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.49 -32.05 67.81 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.337 0.589 . . . . 0.0 110.605 179.953 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.611 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.65 -38.67 72.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.142 0.496 . . . . 0.0 110.314 171.875 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' 1026 ' ' HIS . 96.2 t -65.81 -34.2 68.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.052 174.594 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.6 p30 -72.76 -39.86 66.48 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.858 -172.546 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.546 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -61.05 -54.31 46.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.084 0.468 . . . . 0.0 110.444 174.459 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.413 ' HA ' ' HB3' ' A' 1036 ' ' LEU . 20.0 ttpt -71.74 -22.89 61.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.372 -173.291 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.473 ' O ' HG23 ' A' 1038 ' ' VAL . 19.9 t-20 -73.94 -32.32 63.45 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.168 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 984' ' ' ILE . 19.6 tp -76.46 -33.61 58.72 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.659 ' HA ' HD11 ' A' 1039 ' ' ILE . 0.0 OUTLIER -48.24 -42.56 30.71 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 174.733 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.636 ' N ' HD13 ' A' 1036 ' ' LEU . 23.1 t70 -72.39 -45.3 60.36 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.174 0.511 . . . . 0.0 110.057 177.147 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.744 HG11 ' HA ' ' A' ' 984' ' ' ILE . 40.8 t -48.32 -63.55 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.684 175.673 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.849 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -78.77 -29.01 14.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.098 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.734 ' H ' HD12 ' A' 1039 ' ' ILE . 1.0 OUTLIER -50.53 -48.49 57.19 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 166.09 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.748 ' O ' ' HG2' ' A' 1045 ' ' LYS . 94.5 mt-30 -74.78 -32.49 62.05 Favored 'General case' 0 C--O 1.2 -1.544 0 CA-C-N 113.413 -1.721 . . . . 0.0 111.22 175.592 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.778 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.28 -55.45 21.28 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 118.763 0.711 . . . . 0.0 112.109 178.778 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.885 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 4.0 tpt180 -54.65 -35.95 64.05 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.418 174.296 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.92 -26.17 59.43 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.297 175.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 73.2 mmtt -65.39 -32.79 74.6 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.701 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.44 ' HB2' HG12 ' A' ' 975' ' ' VAL . 1.7 tmt? -64.45 -40.02 94.93 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.811 175.759 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.11 -37.15 79.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.954 172.389 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.435 ' HB3' ' O ' ' A' 1045 ' ' LYS . 33.2 t -59.19 -37.52 77.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.107 0.48 . . . . 0.0 110.533 177.026 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 23.0 tm0? -72.64 -29.47 63.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.302 178.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 25.9 m -84.37 -31.98 24.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.053 -178.559 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 26.7 tpt180 -156.55 105.37 2.0 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.775 179.079 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -88.26 21.27 1.02 Allowed 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.964 2.442 . . . . 0.0 113.138 -176.949 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.532 -179.873 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.778 ' CD ' ' HB2' ' A' 1044 ' ' LEU . 4.1 ttt-85 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 33.5 m 60.31 15.36 5.33 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.868 0.467 . . . . 0.0 111.923 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 43.06 52.46 5.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 123.522 0.729 . . . . 0.0 110.845 -174.479 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.477 ' O ' ' N ' ' A' ' 925' ' ' VAL . 23.5 t0 -46.56 -175.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 O-C-N 125.638 1.837 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.651 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.9 tmtm? -34.33 -25.23 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.032 0.933 . . . . 0.0 112.46 178.523 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.755 ' HA ' HG21 ' A' ' 968' ' ' THR . 4.5 m -56.52 -50.66 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 174.028 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' A' 1036 ' ' LEU . 27.2 t80 -76.94 -35.41 57.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -177.476 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.64 -53.65 54.93 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.607 -1.633 . . . . 0.0 111.546 -177.001 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.18 -44.99 86.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.203 -173.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.909 ' HB ' HD23 ' A' 1036 ' ' LEU . 16.6 t -60.92 -34.84 61.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.076 -0.649 . . . . 0.0 111.217 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.656 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 87.6 m -60.67 -39.37 88.15 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 173.137 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.61 70.01 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 114.982 -1.008 . . . . 0.0 113.318 174.131 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.909 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 10.8 tp -68.41 -35.0 77.01 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 109.51 176.361 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 936' ' ' VAL . 45.9 t -70.33 -38.56 74.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.3 0.571 . . . . 0.0 110.028 172.359 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.656 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -64.29 -25.35 68.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.462 177.23 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.597 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -75.37 -29.96 60.04 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.257 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 10.2 p -79.7 -13.67 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.043 173.29 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 47.0 mm -73.37 -42.48 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 166.202 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.534 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.2 mm-40 -52.6 -41.94 64.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.222 169.273 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.545 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 14.4 ttt -59.09 -41.06 87.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.895 177.756 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.61 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 19.9 m -66.25 -37.07 84.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.506 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.1 m -77.67 -40.36 41.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -176.787 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.704 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.6 mmtp -62.95 -40.02 96.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.457 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' A' ' 946' ' ' ALA . 9.5 tp -73.98 -23.19 18.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 O-C-N 123.127 0.267 . . . . 0.0 111.216 -177.831 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.667 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 77.6 mt-30 -53.52 -54.09 49.52 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.706 177.799 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.667 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 63.1 Cg_endo -100.54 21.66 0.22 Allowed 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.999 1.799 . . . . 0.0 113.473 173.986 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 943' ' ' ILE . . . -89.21 128.57 51.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -173.289 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.45 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 1.8 Cg_endo -84.99 179.2 4.32 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.465 2.777 . . . . 0.0 108.489 159.015 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.584 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 7.1 Cg_endo -50.86 -34.64 46.02 Favored 'Trans proline' 0 C--O 1.245 0.829 0 C-N-CA 122.167 1.912 . . . . 0.0 111.731 178.061 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 17.8 mm-40 -55.6 -37.49 68.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.353 178.224 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.547 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.8 mp0 -96.45 -5.55 39.36 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 178.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.584 ' CD1' ' HA ' ' A' ' 948' ' ' PRO . 10.6 m-85 -57.75 -42.12 83.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 172.713 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.016 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -71.79 -51.98 8.43 Favored Pre-proline 0 CA--C 1.555 1.14 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.246 177.168 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.016 ' HD3' HG13 ' A' ' 952' ' ' VAL . 96.8 Cg_exo -51.42 -41.06 61.4 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.734 2.29 . . . . 0.0 115.135 174.629 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.704 ' HB3' ' HB3' ' A' ' 942' ' ' LYS . 14.8 ptt? -60.21 -50.06 75.15 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.706 0.765 . . . . 0.0 110.093 -179.012 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' A' 1002 ' ' MET . 2.7 t -63.54 -26.82 41.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.785 174.302 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 39.1 ttmt -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.1 mm-40 -56.0 -46.96 78.58 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.45 174.911 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 1.018 HG23 HD22 ' A' ' 998' ' ' LEU . 3.1 m -68.66 -26.27 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.834 177.474 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.455 ' HA2' HD21 ' A' ' 998' ' ' LEU . . . -75.18 -44.11 23.92 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.061 -1.066 . . . . 0.0 112.58 -179.804 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.6 -25.03 64.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.912 0.387 . . . . 0.0 110.482 172.26 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.909 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.24 -52.98 59.94 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.069 174.645 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 1.021 ' HB2' HD23 ' A' ' 995' ' ' LEU . 18.0 tp -53.3 -44.92 68.7 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.055 0.389 . . . . 0.0 111.213 172.81 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 30.1 mmm180 -56.26 -54.87 40.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.954 0.407 . . . . 0.0 111.122 177.274 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.4 m -53.81 -43.21 69.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.464 0.65 . . . . 0.0 110.945 174.796 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.601 HD21 HD12 ' A' 1035 ' ' LEU . 36.6 tp -61.92 -37.11 83.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.598 179.157 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.0 tp -52.92 -36.56 59.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.182 178.097 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.06 95.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.151 0.5 . . . . 0.0 110.335 174.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 925' ' ' VAL . 5.7 m -66.46 -34.02 77.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 174.239 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.652 HG13 HD11 ' A' ' 984' ' ' ILE . 73.3 t -55.25 -31.72 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.509 172.781 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.627 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.9 t70 -76.63 -22.78 53.65 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.242 177.72 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.661 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 50.7 mm-40 -68.99 -50.79 45.9 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 122.972 1.368 . . . . 0.0 108.587 170.128 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.631 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.3 t -65.53 -24.93 67.24 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.34 177.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.69 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.3 tp -61.11 -48.87 90.83 Favored Pre-proline 0 C--O 1.217 -0.616 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.619 -176.319 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 32.3 Cg_exo -61.57 -27.98 82.45 Favored 'Trans proline' 0 C--N 1.355 0.876 0 CA-C-N 121.246 1.481 . . . . 0.0 110.578 170.24 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.6 t -76.86 -10.31 13.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.496 175.676 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.69 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 3.7 tt -68.04 -53.82 18.36 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.226 176.303 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.62 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.5 Cg_exo -62.9 -24.32 74.22 Favored 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 121.437 1.425 . . . . 0.0 111.054 174.36 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -56.83 11.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.585 172.886 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 4.7 m -169.02 -33.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.975 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.728 HG22 ' HB ' ' A' ' 984' ' ' ILE . 8.3 m -54.99 -19.57 7.11 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -174.695 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.611 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 83.5 t60 -48.5 -20.12 0.4 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.363 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 982' ' ' ARG . 23.6 ttt85 -77.4 -55.52 5.33 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.301 179.203 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.92 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.1 OUTLIER -79.57 -43.76 22.39 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.11 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.728 ' HB ' HG22 ' A' ' 980' ' ' THR . 7.9 tp -56.04 -37.86 50.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.796 -170.406 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 14.7 pt-20 -75.76 -40.71 54.84 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.146 177.034 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.731 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 13.8 ptp -61.25 -50.15 74.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.555 -173.918 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.6 -32.67 47.64 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.204 -177.737 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 984' ' ' ILE . 50.9 tt0 -62.38 -50.32 72.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.34 -179.887 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -65.16 -32.03 73.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.351 0.596 . . . . 0.0 109.935 175.386 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.3 tp -61.14 -58.86 6.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.353 176.611 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 3.1 pp -70.86 -19.05 62.68 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.447 -176.728 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 996' ' ' ALA . 6.7 t30 -59.61 -38.17 80.59 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 173.896 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 50.5 m -77.6 -30.47 52.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -178.832 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.649 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.4 m-20 -103.36 -27.49 12.4 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 119.629 -0.828 . . . . 0.0 112.4 -175.473 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.021 HD23 ' HB2' ' A' ' 962' ' ' LEU . 7.1 mp -71.8 -15.74 62.16 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 163.088 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 996' ' ' ALA . . . . . 0.604 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -68.88 -41.82 77.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.308 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 994' ' ' ASP . 7.8 mm-40 -58.26 -33.21 69.15 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.952 171.704 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 1.018 HD22 HG23 ' A' ' 958' ' ' VAL . 0.6 OUTLIER -58.33 -35.64 72.19 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.013 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.604 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 1.7 mp -60.24 -42.78 91.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.449 175.4 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.706 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 92.5 m-20 -77.69 -19.37 55.43 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.307 177.284 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.715 ' HD3' ' HA ' ' A' ' 998' ' ' LEU . 9.2 mtpm? -66.9 -44.53 80.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.165 0.507 . . . . 0.0 109.781 174.823 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.925 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 22.3 ptp -76.59 -36.38 57.57 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.681 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.789 ' O ' ' HB2' ' A' 1007 ' ' GLN . 23.4 tptm -67.5 -62.59 1.34 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.893 -179.335 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' 1017 ' ' TYR . 2.9 tt -52.19 -56.17 16.33 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.454 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.75 -53.59 56.14 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.301 -174.102 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -17.99 64.6 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.169 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.789 ' HB2' ' O ' ' A' 1003 ' ' LYS . 21.8 tp60 -88.56 -38.45 14.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.469 0.652 . . . . 0.0 110.755 -176.491 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.586 ' CD2' ' CE1' ' A' 1017 ' ' TYR . 0.2 OUTLIER -103.37 7.89 38.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.285 -172.476 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.684 ' HA ' ' NE2' ' A' 1014 ' ' GLN . 7.5 p -41.62 124.68 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 114.276 -1.329 . . . . 0.0 113.213 -174.987 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.61 ' SD ' HD12 ' A' 1013 ' ' LEU . 40.1 ttm -150.8 57.09 0.92 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.059 175.84 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 20.2 m 50.52 -93.54 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.045 -0.98 . . . . 0.0 113.352 175.905 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 22.7 t -77.73 -27.92 50.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.266 0.555 . . . . 0.0 110.575 -174.162 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.61 HD12 ' SD ' ' A' 1010 ' ' MET . 60.5 mt -78.37 -5.87 53.52 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.621 179.068 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.684 ' NE2' ' HA ' ' A' 1009 ' ' VAL . 4.8 tp-100 -60.96 -25.23 66.68 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 121.725 0.774 . . . . 0.0 110.295 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' 1018 ' ' LYS . 0.7 OUTLIER -65.54 -41.08 93.42 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.875 -179.473 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -50.22 -52.13 38.53 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.698 173.138 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.825 ' HB3' HD22 ' A' 1004 ' ' LEU . 0.9 OUTLIER -73.96 -19.44 60.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.343 0.592 . . . . 0.0 110.595 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' 1015 ' ' GLN . 23.1 tptm -71.34 -46.06 61.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.89 171.179 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -58.05 -56.42 22.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.159 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -47.94 -41.32 24.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.825 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.539 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 2.6 ptp -77.27 -23.34 51.2 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.998 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 67.3 tp -69.05 -39.76 78.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.143 0.497 . . . . 0.0 109.944 179.064 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 20.7 m -64.97 -33.75 76.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.05 175.362 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.34 -26.78 46.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.386 177.865 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.83 -37.08 73.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.193 177.927 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.492 ' O ' HG23 ' A' 1030 ' ' VAL . 20.3 t60 -66.6 -42.91 86.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.63 175.627 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.65 -51.2 68.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.115 178.944 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -64.75 -33.71 76.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.691 -179.089 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.587 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.06 -43.16 86.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.362 172.908 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' 1026 ' ' HIS . 96.0 t -67.35 -38.97 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 177.186 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.801 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 4.9 m-20 -61.24 -44.49 97.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.846 177.529 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.39 -57.04 12.82 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.964 0.412 . . . . 0.0 110.351 167.651 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' 1036 ' ' LEU . 84.9 mttt -66.22 -22.99 66.35 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -170.871 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' 1038 ' ' VAL . 66.8 t30 -73.34 -41.15 63.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.776 175.697 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.737 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tm? -75.56 -26.12 57.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.605 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.909 HD23 ' HB ' ' A' ' 929' ' ' VAL . 3.1 tm? -54.35 -52.04 62.86 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.198 169.575 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 18.9 t70 -72.34 -36.17 68.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.646 -178.694 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.92 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.3 t -51.69 -60.8 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.333 174.373 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.706 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 29.1 pt -89.83 -24.48 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -171.711 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -53.63 -48.25 69.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 162.84 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' A' 1045 ' ' LYS . 31.7 mt-30 -74.43 -21.65 59.51 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.248 176.366 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.706 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.94 -54.04 40.77 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 118.801 0.728 . . . . 0.0 110.625 171.567 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.703 ' HB3' ' HA ' ' A' ' 920' ' ' ARG . 3.3 mpt_? -53.17 -34.79 58.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 173.411 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.778 ' HB2' ' CD ' ' A' ' 920' ' ' ARG . 3.3 tm? -73.73 -34.13 64.64 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.296 173.82 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.8 mmtt -55.81 -28.31 55.63 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.529 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.4 ttm -72.12 -46.76 55.38 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.185 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.44 ' HB ' HD22 ' A' 1044 ' ' LEU . 41.0 mm -64.69 -41.85 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.821 175.358 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 20.6 t -52.73 -41.58 64.1 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.301 175.782 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 25.1 tm0? -81.18 -30.25 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.357 -178.766 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 36.5 m -76.53 -70.85 0.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.611 -177.878 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -144.98 98.33 4.77 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.488 -175.305 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.79 77.74 2.22 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.788 2.326 . . . . 0.0 112.093 177.632 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 66.3 t60 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.625 -0.703 . . . . 0.0 109.439 -179.609 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.626 ' CG ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.536 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 16.7 m -59.05 141.13 54.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 166.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.744 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.32 82.02 0.15 Allowed 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 122.313 0.245 . . . . 0.0 111.422 -174.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 925' ' ' VAL . 3.3 t70 -46.23 -174.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 O-C-N 126.028 2.08 . . . . 0.0 113.055 -170.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.2 tmtp? -42.97 -19.38 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.281 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.882 ' HA ' HG23 ' A' ' 968' ' ' THR . 2.3 m -60.15 -56.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.867 174.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 57.3 t80 -78.67 -25.03 44.82 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.425 1.107 . . . . 0.0 108.508 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 98.3 mt-10 -63.6 -62.82 1.42 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.799 -1.546 . . . . 0.0 111.807 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.42 -32.94 66.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.196 -0.456 . . . . 0.0 112.188 -171.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.819 HG21 HD11 ' A' 1039 ' ' ILE . 19.0 m -60.65 -36.47 70.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.727 0.299 . . . . 0.0 111.512 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.655 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.5 m -61.45 -36.9 81.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 171.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.95 63.24 Favored Glycine 0 CA--C 1.522 0.504 0 CA-C-N 114.558 -1.201 . . . . 0.0 113.279 175.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 1.07 HD12 HD22 ' A' ' 965' ' ' LEU . 3.1 tt -63.86 -50.74 67.64 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.514 ' O ' HG22 ' A' ' 936' ' ' VAL . 39.4 t -58.51 -42.02 83.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.083 0.468 . . . . 0.0 110.316 178.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.655 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -63.19 -28.81 70.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.115 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.564 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . . . -79.37 -25.45 42.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.466 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 0.9 OUTLIER -78.75 -14.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.227 173.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.504 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 70.3 mt -69.59 -35.31 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 168.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 13.7 mm-40 -54.59 -38.43 66.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.284 171.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.905 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 44.4 ttm -58.02 -43.36 86.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.144 0.497 . . . . 0.0 110.04 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 14.0 m -68.33 -39.95 81.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.043 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.544 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 17.2 p -76.93 -35.94 56.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -173.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 7.4 mmtp -54.78 -47.92 73.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.516 -1.22 . . . . 0.0 112.147 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.547 ' HB ' ' CE ' ' A' ' 954' ' ' MET . 10.8 tt -71.24 -24.37 24.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.435 -174.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.714 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 85.1 mt-30 -57.52 -57.88 22.14 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.9 Cg_endo -96.2 -16.31 0.38 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.46 1.44 . . . . 0.0 114.124 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -103.35 158.33 32.03 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -171.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.779 ' HG2' ' HG2' ' A' ' 949' ' ' GLU . 84.0 Cg_endo -92.31 -174.97 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 123.804 3.003 . . . . 0.0 113.155 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.628 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 81.7 Cg_exo -49.83 -31.64 27.05 Favored 'Trans proline' 0 C--N 1.363 1.291 0 C-N-CA 123.719 2.946 . . . . 0.0 114.885 -178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.779 ' HG2' ' HG2' ' A' ' 947' ' ' PRO . 11.7 pt-20 -55.48 -29.5 58.88 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.634 176.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 51.0 mm-40 -98.14 -5.54 33.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.604 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.779 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.8 m-85 -55.0 -46.08 75.12 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.994 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -70.1 -51.96 13.36 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 119.267 -0.973 . . . . 0.0 112.324 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.994 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.9 Cg_exo -53.04 -31.98 56.32 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.731 2.287 . . . . 0.0 115.158 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.905 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.7 ptp -64.8 -39.83 94.23 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.021 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.636 ' O ' HG22 ' A' ' 958' ' ' VAL . 65.7 t -67.12 -28.01 41.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.917 169.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.9 tptm -65.25 -33.82 76.89 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.6 mm-40 -56.31 -47.38 78.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.971 174.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 955' ' ' VAL . 3.2 m -70.36 -25.15 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.437 174.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.734 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.03 -45.81 61.28 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.083 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 960' ' ' LEU . 2.3 tm? -62.35 -30.49 71.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.961 0.41 . . . . 0.0 109.917 171.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.734 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.18 -57.01 14.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.072 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.946 ' HB2' HD13 ' A' ' 995' ' ' LEU . 2.9 tm? -60.55 -40.62 92.22 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.578 177.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -50.39 -56.59 10.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.555 0.693 . . . . 0.0 110.894 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.9 m -53.35 -40.51 64.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.238 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 1.07 HD22 HD12 ' A' ' 932' ' ' LEU . 6.3 mp -68.3 -27.22 66.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.523 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.8 tt -56.96 -36.13 69.94 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.53 97.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.284 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.882 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -62.23 -41.4 98.37 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.809 173.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 965' ' ' LEU . 87.9 t -55.11 -31.85 26.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.927 174.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.9 t70 -75.84 -34.09 60.08 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.129 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.578 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.8 mm-40 -59.73 -53.13 61.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.515 1.15 . . . . 0.0 108.762 172.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.463 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.0 t -67.57 -22.3 65.4 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.756 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.716 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 28.7 tp -53.3 -55.62 32.57 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 118.579 -0.725 . . . . 0.0 112.144 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.716 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 35.4 Cg_exo -63.8 -23.8 68.8 Favored 'Trans proline' 0 C--N 1.358 1.069 0 CA-C-N 121.127 1.438 . . . . 0.0 111.02 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.532 HG13 ' HB2' ' A' 1046 ' ' MET . 11.5 t -77.51 -8.62 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.162 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.622 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -83.47 -40.14 0.77 Allowed Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.363 -0.836 . . . . 0.0 111.951 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.622 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 18.3 Cg_endo -63.99 -23.91 67.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 120.797 1.321 . . . . 0.0 110.133 168.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 975' ' ' VAL . . . -64.87 -62.68 1.42 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.148 169.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.867 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.4 m -165.76 -32.31 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.687 HG22 ' HB ' ' A' ' 984' ' ' ILE . 3.4 m -57.27 -18.22 15.47 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.649 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.0 p-80 -48.71 -20.75 0.5 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -174.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -70.97 -57.41 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.486 177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.951 ' HG2' HG22 ' A' 1038 ' ' VAL . 0.0 OUTLIER -82.91 -34.5 26.61 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -178.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.687 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.2 tp -61.76 -24.48 34.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -74.78 -48.98 22.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 168.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.733 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 10.6 ptp -63.84 -44.81 92.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.781 -171.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.782 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.71 -46.01 19.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 1.077 ' HA ' HD12 ' A' ' 991' ' ' LEU . 22.8 tm0? -62.87 -43.77 97.91 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.87 -175.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 54.3 mttp -62.33 -33.9 75.59 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.341 0.591 . . . . 0.0 109.7 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.552 ' HG ' ' CB ' ' A' 1031 ' ' ASP . 3.6 tp -71.49 -38.82 71.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.744 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.077 HD12 ' HA ' ' A' ' 988' ' ' GLN . 5.6 mt -61.79 -51.59 67.66 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.493 0.663 . . . . 0.0 109.451 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.49 -45.12 77.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.065 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.67 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 50.0 m -64.64 -48.44 74.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.168 -177.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.34 -40.13 8.06 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -167.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.053 ' HA ' HD12 ' A' 1028 ' ' LEU . 3.5 tt -60.99 -41.14 95.9 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.723 175.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -61.43 -42.57 98.95 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 993' ' ' SER . 68.4 mm-40 -52.39 -48.35 65.69 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.088 175.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.536 ' O ' HG11 ' A' ' 955' ' ' VAL . 4.0 mm? -58.55 -37.26 75.32 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 110.191 -175.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -58.04 -44.43 87.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.195 -178.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.701 ' O ' ' HB2' ' A' 1004 ' ' LEU . 16.6 m-80 -93.81 -11.17 31.86 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.483 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.485 ' HA ' ' HD3' ' A' 1001 ' ' LYS . 36.1 mmtm -85.97 -40.66 15.61 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.281 -0.168 . . . . 0.0 111.316 -176.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.683 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 42.5 tpp -77.44 -36.5 53.01 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 172.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.82 ' O ' ' HB2' ' A' 1007 ' ' GLN . 63.0 tttp -53.87 -53.4 53.05 Favored 'General case' 0 C--O 1.211 -0.939 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 171.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.701 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.7 tt -53.06 -52.2 59.31 Favored 'General case' 0 C--O 1.22 -0.482 0 O-C-N 123.932 0.77 . . . . 0.0 111.336 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.464 ' O ' ' HD2' ' A' 1017 ' ' TYR . . . -55.76 -52.22 64.7 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.09 0.472 . . . . 0.0 109.939 -178.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.578 HE21 ' HB3' ' A' ' 948' ' ' PRO . 7.4 mm100 -72.74 -9.83 59.09 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.626 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.82 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.8 tp-100 -95.34 -27.44 15.46 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.399 0.619 . . . . 0.0 110.823 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 23.4 t80 . . . . . 0 C--N 1.315 -0.926 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.406 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 8.7 tp60 . . . . . 0 N--CA 1.461 0.1 0 CA-C-O 121.452 0.644 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' 1019 ' ' LYS . 12.4 pt20 -70.22 -26.6 63.94 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.918 -177.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -53.74 -53.82 46.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.586 0.231 . . . . 0.0 110.875 166.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.464 ' HD2' ' O ' ' A' 1005 ' ' ALA . 0.4 OUTLIER -64.1 -25.16 67.98 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.529 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 28.8 tptp -74.42 -25.29 59.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.389 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' 1015 ' ' GLN . 34.7 mmtp -68.55 -57.67 5.43 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -50.26 -35.08 25.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.323 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.423 ' HE2' ' HB2' ' A' 1025 ' ' ALA . 1.7 tmt? -66.4 -43.58 85.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.765 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 41.3 tp -64.49 -39.25 93.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.756 0.312 . . . . 0.0 110.954 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 41.1 m -63.05 -32.88 74.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.596 0.713 . . . . 0.0 110.335 175.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.513 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.12 -39.77 40.23 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.812 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.423 ' HB2' ' HE2' ' A' 1021 ' ' MET . . . -60.4 -35.18 75.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.78 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 11.2 t-80 -62.97 -39.2 93.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.898 174.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.8 82.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.52 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.053 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.94 -34.28 71.32 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.317 0.579 . . . . 0.0 110.296 179.297 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.631 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.59 -32.78 65.56 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.629 -0.67 . . . . 0.0 110.666 171.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 99.3 t -71.7 -27.99 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.68 175.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.552 ' CB ' ' HG ' ' A' ' 990' ' ' LEU . 2.5 p30 -74.27 -40.92 62.01 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.632 -0.827 . . . . 0.0 109.478 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -60.28 -49.65 76.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.69 ' O ' ' HG ' ' A' 1036 ' ' LEU . 54.1 tptt -59.97 -49.48 77.53 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.787 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' 1038 ' ' VAL . 65.9 t30 -62.76 -43.61 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.378 -176.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 991' ' ' LEU . 19.1 tp -72.82 -38.08 67.29 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.031 -175.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.74 ' HA ' HG21 ' A' ' 929' ' ' VAL . 3.5 pp -61.0 -19.55 61.45 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 120.688 0.28 . . . . 0.0 110.586 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -98.52 -33.96 10.79 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.951 HG22 ' HG2' ' A' ' 983' ' ' GLU . 19.9 t -53.11 -58.9 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.875 172.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.838 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -83.19 -24.32 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.749 -177.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.697 ' H ' HD12 ' A' 1039 ' ' ILE . 8.6 t70 -58.12 -42.21 85.26 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 163.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' 1045 ' ' LYS . 36.5 mt-30 -68.29 -34.73 76.7 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.888 172.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.756 ' HA ' ' HG2' ' A' 1045 ' ' LYS . . . -52.39 -51.61 58.1 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.891 0.377 . . . . 0.0 110.952 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.744 ' HG3' ' HA ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER -47.28 -41.48 18.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.378 172.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.697 ' N ' ' HD3' ' A' 1043 ' ' ARG . 28.0 tp -80.37 -26.64 38.51 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.966 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.867 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.0 mmmt -64.32 -39.94 94.92 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.532 ' HB2' HG13 ' A' ' 975' ' ' VAL . 13.7 tmm? -63.2 -43.32 98.48 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.705 176.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 41.8 mm -62.71 -44.17 99.25 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 173.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.6 m -47.83 -45.17 29.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.596 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 . . . . . 0 C--N 1.329 -0.31 0 CA-C-O 120.883 0.373 . . . . 0.0 111.531 179.702 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 4.9 tpp180 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.4 m -86.37 50.56 2.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.538 ' H ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER 42.3 52.45 4.58 Favored 'General case' 0 CA--C 1.498 -1.051 0 C-N-CA 123.494 0.717 . . . . 0.0 111.728 176.1 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.9 t70 -46.77 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 O-C-N 125.694 1.871 . . . . 0.0 112.742 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.729 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.5 tmtp? -36.4 -21.16 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 124.212 1.005 . . . . 0.0 112.519 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.743 ' HA ' HG23 ' A' ' 968' ' ' THR . 19.2 m -60.49 -53.84 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 C-N-CA 123.284 0.634 . . . . 0.0 112.364 175.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.451 ' N ' HG23 ' A' ' 925' ' ' VAL . 38.5 t80 -79.77 -37.37 35.5 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 122.084 0.945 . . . . 0.0 108.908 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 45.7 mt-10 -58.37 -54.84 42.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.703 -178.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.729 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 65.6 t30 -73.68 -33.01 64.24 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -172.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.644 HG11 ' N ' ' A' 1036 ' ' LEU . 21.3 t -63.06 -32.97 58.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.567 172.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.633 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.8 m -61.31 -35.83 78.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 170.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.87 -31.97 69.27 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.18 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.932 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.5 tt -64.12 -38.4 90.92 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.606 ' HA ' HG12 ' A' ' 936' ' ' VAL . 22.0 t -69.4 -41.49 80.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.933 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -58.67 -35.29 72.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.177 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.38 -24.78 42.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.788 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.606 HG12 ' HA ' ' A' ' 933' ' ' VAL . 9.1 p -83.12 -15.39 11.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.406 171.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -68.94 -37.72 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 165.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.743 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.0 mm-40 -52.48 -36.88 55.95 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.744 169.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.3 tmm? -60.99 -41.92 97.4 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.579 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 50.2 m -73.82 -31.26 63.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.735 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 938' ' ' GLU . 22.9 p -77.05 -43.35 34.79 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.691 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.3 mmtp -52.76 -53.24 50.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.187 174.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.854 HG13 ' HE1' ' A' ' 951' ' ' TYR . 14.2 tt -63.58 -23.62 33.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.8 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 73.7 mt-30 -55.39 -62.79 3.84 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.319 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.8 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 44.4 Cg_endo -97.31 25.47 0.24 Allowed 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 121.631 1.554 . . . . 0.0 114.028 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.887 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -113.58 138.8 22.73 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.66 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 69.0 Cg_endo -88.38 -174.07 1.03 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 123.611 2.874 . . . . 0.0 109.972 165.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.783 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 8.1 Cg_endo -51.87 -31.92 44.84 Favored 'Trans proline' 0 C--O 1.247 0.935 0 C-N-CA 122.4 2.067 . . . . 0.0 112.361 176.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.42 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 48.1 mt-10 -52.75 -38.56 61.12 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.775 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.887 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 44.2 mt-10 -104.49 6.42 34.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.854 ' HE1' HG13 ' A' ' 943' ' ' ILE . 5.4 m-30 -66.5 -38.3 86.93 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 170.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.112 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -75.87 -47.72 3.79 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.211 174.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.112 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.2 Cg_exo -55.28 -26.5 52.5 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.719 1.612 . . . . 0.0 114.943 172.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.644 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 16.8 ptp -73.37 -36.01 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.596 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.972 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -64.08 -27.47 42.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.424 169.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 20.7 ttmm -58.49 -38.45 77.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 175.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.429 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 4.9 mm-40 -57.87 -48.18 80.58 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.271 178.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 936' ' ' VAL . 6.1 m -73.3 -22.61 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 O-C-N 122.205 -0.31 . . . . 0.0 111.198 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.473 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.29 -44.42 34.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.224 -0.989 . . . . 0.0 111.459 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.28 -26.83 68.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.389 171.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.932 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.28 -54.4 37.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 174.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 965' ' ' LEU . 3.4 tm? -62.09 -37.15 83.97 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 959' ' ' GLY . 34.1 mmt180 -56.25 -60.22 3.81 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 172.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 2.1 p -52.79 -40.76 63.5 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.194 0.521 . . . . 0.0 110.211 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 962' ' ' LEU . 2.7 tm? -57.05 -35.29 69.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.026 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.45 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 48.6 tp -64.64 -29.04 70.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -178.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.58 96.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.178 0.513 . . . . 0.0 110.097 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.743 HG23 ' HA ' ' A' ' 925' ' ' VAL . 4.5 m -64.24 -35.97 82.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.628 173.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.737 HG13 HD11 ' A' ' 984' ' ' ILE . 83.1 t -54.95 -31.09 24.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.726 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.534 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -74.87 -28.3 60.6 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 120.528 0.204 . . . . 0.0 111.485 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 23.8 mm-40 -64.79 -53.99 38.25 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 123.027 1.394 . . . . 0.0 108.543 172.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.478 ' HB3' HG23 ' A' 1039 ' ' ILE . 10.4 p -67.24 -22.15 65.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.888 -1.505 . . . . 0.0 111.301 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.708 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 44.6 tp -54.34 -54.67 45.49 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-O 118.938 -0.553 . . . . 0.0 112.127 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 31.3 Cg_exo -62.39 -25.39 76.22 Favored 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 121.3 1.333 . . . . 0.0 110.941 171.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 980' ' ' THR . 49.4 t -73.6 -12.88 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.567 174.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.779 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 4.9 tt -74.46 -53.96 3.29 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.557 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.3 Cg_exo -62.36 -22.26 73.84 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.111 1.207 . . . . 0.0 110.693 173.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . 0.543 ' HA ' ' HG3' ' A' 1049 ' ' GLN . . . -70.35 -65.13 0.77 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.101 173.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.1 m -161.38 -32.76 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.788 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -172.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.656 HG22 ' HA ' ' A' ' 976' ' ' LEU . 1.4 t -66.27 -13.82 61.02 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -173.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.779 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 42.4 t60 -49.83 -21.82 1.26 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.879 0.471 . . . . 0.0 112.097 -174.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.562 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 6.1 ptp180 -78.68 -53.43 7.16 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.024 0.44 . . . . 0.0 110.634 176.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.812 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.2 OUTLIER -77.48 -46.27 23.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -175.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.737 HD11 HG13 ' A' ' 969' ' ' VAL . 11.8 tt -55.45 -34.56 34.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.119 0.485 . . . . 0.0 110.112 -174.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -72.94 -34.26 66.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.305 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.624 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 23.1 ptm -66.22 -58.04 6.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.332 -0.547 . . . . 0.0 112.006 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.603 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.42 -36.29 33.91 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 6.5 tp60 -67.15 -36.25 81.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.774 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -66.86 -31.41 71.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.596 0.712 . . . . 0.0 109.123 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.425 HD11 ' CG ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -71.45 -39.44 70.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.628 178.315 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.797 ' HA ' ' OD1' ' A' ' 994' ' ' ASP . 47.3 mt -74.03 -29.12 61.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.299 -176.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -60.95 -43.62 98.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 15.5 m -77.65 -33.85 53.34 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.804 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.797 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p-10 -91.37 -38.07 12.83 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.853 -0.529 . . . . 0.0 111.247 -170.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.518 ' HA ' ' CD1' ' A' 1028 ' ' LEU . 2.7 tm? -59.01 -37.13 76.2 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.586 ' O ' HG22 ' A' ' 999' ' ' ILE . . . -59.93 -51.85 67.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.224 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' 1001 ' ' LYS . 2.8 pt-20 -63.7 -35.23 79.88 Favored 'General case' 0 C--O 1.215 -0.731 0 C-N-CA 118.688 -1.205 . . . . 0.0 110.105 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.557 HD11 ' CA ' ' A' 1025 ' ' ALA . 1.8 mm? -69.43 -42.34 75.14 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.689 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.808 ' HA ' HG11 ' A' ' 955' ' ' VAL . 17.4 tt -59.65 -25.36 31.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.009 0.433 . . . . 0.0 110.804 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.691 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.0 OUTLIER -104.03 -7.71 20.1 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.987 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 31.0 mmtp -83.48 -37.69 22.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.972 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 18.9 mmt -72.91 -41.97 64.04 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.735 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.8 ttpt -58.13 -48.71 79.38 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 114.275 -1.33 . . . . 0.0 109.639 172.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1000 ' ' ASN . 45.7 tp -58.5 -45.74 88.14 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.7 ' HB1' HE22 ' A' 1014 ' ' GLN . . . -63.77 -49.3 73.5 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.372 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.2 pp0? -67.24 -17.64 64.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.901 176.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.735 ' HB2' ' O ' ' A' 1003 ' ' LYS . 6.2 tp-100 -77.77 -33.64 52.65 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.6 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.564 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 17.4 t80 . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.393 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.75 ' HG3' ' HE2' ' A' ' 951' ' ' TYR . 0.6 OUTLIER . . . . . 0 N--CA 1.444 -0.772 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.557 ' O ' ' HG3' ' A' 1019 ' ' LYS . 45.0 mt-30 -59.8 -48.28 82.3 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -156.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -50.88 -52.13 44.83 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 111.309 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.58 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.7 m-30 -72.09 -24.72 61.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.849 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.673 ' HA ' ' HB3' ' A' 1021 ' ' MET . 24.3 tttt -67.92 -31.28 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.655 0.264 . . . . 0.0 110.52 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' 1015 ' ' GLN . 84.1 mttt -61.45 -57.67 11.28 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.433 ' H ' ' HG3' ' A' 1020 ' ' GLN . 54.2 mt-30 -50.58 -45.44 57.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.999 172.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.673 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 6.4 ttt -56.41 -54.05 50.14 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.527 0.731 . . . . 0.0 112.0 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.93 -45.22 90.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.644 -175.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 17.0 m -61.22 -32.42 72.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.332 0.587 . . . . 0.0 110.612 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.498 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.23 -43.56 28.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.98 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.557 ' CA ' HD11 ' A' ' 998' ' ' LEU . . . -59.1 -31.48 68.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.927 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -70.0 -38.44 75.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.435 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -59.95 -44.11 94.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 174.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.717 ' HA ' ' OD2' ' A' ' 994' ' ' ASP . 1.9 tt -61.76 -54.86 36.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.58 0.705 . . . . 0.0 110.427 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.603 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -56.49 -36.83 69.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.949 -176.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . . . . . . . . . 70.4 t -75.2 -41.68 44.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.808 0.337 . . . . 0.0 110.602 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.471 ' O ' HD21 ' A' ' 991' ' ' LEU . 43.6 m-20 -67.05 -30.0 69.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -52.23 -50.91 61.05 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 164.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' 1036 ' ' LEU . 58.1 mtmt -64.22 -17.41 63.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.596 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' 1038 ' ' VAL . 59.5 t30 -75.38 -37.3 60.65 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.013 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 991' ' ' LEU . 33.3 tp -75.27 -20.44 59.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.644 ' N ' HG11 ' A' ' 929' ' ' VAL . 45.9 tp -57.75 -51.09 71.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.28 174.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -31.46 67.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.728 178.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.812 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 18.6 t -60.69 -62.45 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.005 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.696 HG22 ' HB ' ' A' ' 925' ' ' VAL . 1.8 mt -77.6 -24.8 14.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.343 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.546 ' O ' ' HB3' ' A' 1043 ' ' ARG . 18.0 t70 -61.81 -37.88 86.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.798 165.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.71 ' O ' ' HG2' ' A' 1045 ' ' LYS . 13.3 mm100 -70.74 -32.33 69.46 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.076 171.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.531 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.81 -45.3 74.36 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 121.353 0.597 . . . . 0.0 110.081 171.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.58 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.09 -50.19 15.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.127 170.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.509 ' N ' ' HD3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -79.64 -20.88 45.68 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.374 -0.204 . . . . 0.0 111.416 178.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.783 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 38.0 mmtm -65.22 -40.4 94.03 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.67 -44.45 96.45 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.946 -1.024 . . . . 0.0 109.412 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.427 ' HB ' HD23 ' A' 1044 ' ' LEU . 43.8 mm -64.59 -48.22 85.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.442 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -35.28 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.125 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . 0.543 ' HG3' ' HA ' ' A' ' 978' ' ' ALA . 1.1 tm0? . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.847 ' HA ' ' HE ' ' A' ' 920' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.734 0.302 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -82.49 47.48 1.17 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.564 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.453 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 46.84 72.03 0.27 Allowed 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.951 0.9 . . . . 0.0 113.035 174.53 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.941 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 1.9 t70 -45.44 -175.5 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 O-C-N 125.624 1.828 . . . . 0.0 112.873 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.529 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.1 tmtp? -42.56 -22.66 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.388 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.858 ' HA ' HG23 ' A' ' 968' ' ' THR . 15.5 m -56.64 -51.61 63.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.27 174.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.436 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 5.0 t80 -77.61 -34.43 53.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.179 -1.008 . . . . 0.0 109.348 -175.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -61.68 -49.25 77.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.418 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.437 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.5 -38.21 77.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.539 -176.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 1.073 ' HA ' HD13 ' A' ' 932' ' ' LEU . 2.9 t -66.0 -29.67 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.846 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 38.6 m -61.67 -40.28 94.41 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.08 -27.63 60.16 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 114.568 -1.197 . . . . 0.0 113.351 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 1.101 HD11 ' HB2' ' A' ' 965' ' ' LEU . 10.0 mp -64.13 -41.88 97.05 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 117.86 0.83 . . . . 0.0 109.745 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.592 ' O ' HG23 ' A' ' 937' ' ' ILE . 77.9 t -70.59 -35.38 61.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.307 0.575 . . . . 0.0 109.909 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.2 mmpt? -67.12 -19.14 65.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.168 0.509 . . . . 0.0 109.971 174.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -83.0 -26.54 31.14 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.653 175.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.569 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.5 p -88.13 -15.09 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 120.131 -0.627 . . . . 0.0 110.274 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.592 HG23 ' O ' ' A' ' 933' ' ' VAL . 21.0 pt -75.38 -31.84 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 167.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.9 mm-40 -56.22 -44.84 79.92 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.873 166.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.758 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 26.1 ttt -59.16 -38.98 81.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.726 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.553 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.6 m -67.82 -40.94 83.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.826 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.569 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.4 t -76.05 -41.46 50.62 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -175.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.625 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 10.1 mmtm -47.31 -54.03 12.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.876 176.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.629 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 13.6 tt -71.23 -21.51 21.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.548 -174.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.796 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.3 mm-40 -54.74 -63.02 3.24 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.796 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 93.4 Cg_endo -98.69 -5.64 0.75 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.699 1.599 . . . . 0.0 114.178 -176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -111.7 151.63 43.53 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.502 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 90.3 Cg_endo -78.79 -176.61 3.37 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.563 2.842 . . . . 0.0 112.796 -176.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.732 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 75.3 Cg_exo -51.98 -25.75 23.03 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 123.133 2.555 . . . . 0.0 113.35 175.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.411 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 30.1 mm-40 -56.82 -30.7 63.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.829 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.682 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.9 mp0 -97.63 -1.05 44.56 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.641 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.732 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -57.48 -40.69 79.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 170.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.045 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -74.98 -52.45 3.26 Favored Pre-proline 0 CA--C 1.554 1.133 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.115 177.112 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.045 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.72 -32.33 45.03 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.089 1.859 . . . . 0.0 115.031 172.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.758 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 27.3 ptt? -68.53 -44.54 74.38 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.921 -0.711 . . . . 0.0 110.227 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.683 ' HB ' ' HB3' ' A' 1002 ' ' MET . 70.2 t -66.23 -26.46 38.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.032 170.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 1.6 tmtp? -59.67 -36.99 77.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.2 mm-40 -55.96 -47.35 77.79 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.707 175.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 3.2 m -73.89 -22.06 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 120.762 0.315 . . . . 0.0 111.241 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.68 -43.47 59.87 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.022 175.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.1 tp -60.29 -23.14 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.345 -0.427 . . . . 0.0 110.512 171.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.856 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.99 -56.36 15.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.776 177.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 991' ' ' LEU . 13.9 tp -62.59 -38.67 91.06 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.987 176.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 20.4 tpp180 -51.4 -62.64 1.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 0.0 111.68 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 20.5 p -56.2 -36.82 68.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.841 0.353 . . . . 0.0 110.927 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 1.101 ' HB2' HD11 ' A' ' 932' ' ' LEU . 31.0 tp -58.08 -34.0 69.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.083 176.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 1.142 ' HA ' HG22 ' A' ' 969' ' ' VAL . 4.1 tt -70.32 -24.08 62.95 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.726 -0.389 . . . . 0.0 111.154 -177.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.96 95.87 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 167.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.858 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -69.36 -42.04 75.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.077 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 1.142 HG22 ' HA ' ' A' ' 966' ' ' LEU . 32.9 m -62.44 -26.34 40.19 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.561 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 18.5 t70 -73.25 -22.9 60.3 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.541 173.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.6 mm-40 -74.49 -49.94 20.2 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-O 122.113 0.959 . . . . 0.0 109.296 169.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.628 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 93.6 p -63.9 -26.46 68.61 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.929 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 1.061 ' HA ' HD13 ' A' ' 976' ' ' LEU . 0.9 OUTLIER -59.44 -52.26 75.49 Favored Pre-proline 0 N--CA 1.472 0.647 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.646 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 52.6 Cg_exo -57.2 -26.02 67.53 Favored 'Trans proline' 0 C--N 1.354 0.859 0 CA-C-N 120.687 1.281 . . . . 0.0 110.392 170.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' 1046 ' ' MET . 1.8 t -78.79 -18.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.416 175.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 1.061 HD13 ' HA ' ' A' ' 973' ' ' LEU . 8.5 mp -52.66 -58.42 11.99 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 118.147 0.43 . . . . 0.0 110.265 172.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.63 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 64.4 Cg_exo -54.81 -38.33 92.11 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 121.839 1.693 . . . . 0.0 111.962 174.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.74 -50.18 74.08 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.111 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.598 ' CB ' ' HG3' ' A' 1045 ' ' LYS . 31.1 t 179.63 -26.43 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.871 0.367 . . . . 0.0 111.287 -179.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.64 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 89.9 m -51.56 -21.0 2.2 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -177.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -52.86 -20.13 3.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.675 0.274 . . . . 0.0 111.358 -177.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -76.83 -51.66 10.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.949 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.971 ' HB2' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -65.7 -54.86 21.62 Favored 'General case' 0 CA--C 1.494 -1.205 0 CA-C-O 122.063 0.935 . . . . 0.0 112.142 178.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.947 HG21 ' HG ' ' A' ' 976' ' ' LEU . 9.2 tp -63.73 -34.15 66.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 113.713 -1.585 . . . . 0.0 110.097 -164.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -60.1 -45.39 93.13 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.966 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.55 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 24.5 ptm -73.61 -52.94 11.69 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.201 -175.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.621 ' HB3' HD23 ' A' 1035 ' ' LEU . . . -78.65 -44.94 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -172.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.705 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.0 OUTLIER -63.44 -44.09 95.54 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.068 -0.253 . . . . 0.0 111.148 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -67.46 -31.92 72.41 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.482 0.658 . . . . 0.0 109.655 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 986' ' ' MET . 0.3 OUTLIER -64.52 -50.86 65.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.465 175.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 962' ' ' LEU . 3.5 pp -74.2 -27.35 60.76 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.609 -175.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.545 ' N ' HD12 ' A' ' 991' ' ' LEU . 54.6 t30 -58.17 -42.1 85.29 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.458 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 13.5 m -77.82 -28.36 50.23 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.947 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.26 -43.18 8.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -172.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.01 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.88 -44.46 70.47 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 169.336 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -53.86 -45.76 71.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.258 177.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.701 ' O ' ' HG2' ' A' 1001 ' ' LYS . 22.1 mm-40 -61.36 -34.79 75.88 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 121.676 -0.64 . . . . 0.0 111.675 178.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.677 ' HG ' HD13 ' A' 1028 ' ' LEU . 2.4 mm? -69.31 -34.76 75.16 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.02 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 996' ' ' ALA . 19.9 pt -73.68 -13.36 15.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.938 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.657 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 4.8 p30 -104.15 -3.77 23.99 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.701 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 42.2 mmtm -85.71 -30.61 23.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 170.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.005 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 25.0 ptt? -72.92 -38.1 66.97 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 171.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.785 ' O ' ' HB2' ' A' 1007 ' ' GLN . 17.7 tppt? -63.02 -53.87 47.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.923 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.586 HD12 ' HD3' ' A' 1001 ' ' LYS . 17.1 mt -56.13 -46.81 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.495 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.44 -46.97 88.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.626 0.727 . . . . 0.0 110.373 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.436 ' NE2' HG11 ' A' ' 952' ' ' VAL . 0.3 OUTLIER -75.92 -10.36 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.627 0.727 . . . . 0.0 110.03 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.785 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -88.74 -27.14 21.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.418 -179.151 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 14.6 t80 . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.58 -179.193 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 120.895 0.379 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.657 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 3.9 pt20 -54.86 -35.26 63.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.064 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.414 ' HA ' ' HE2' ' A' 1019 ' ' LYS . 37.7 tt0 -51.39 -52.56 44.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.826 0.346 . . . . 0.0 111.311 172.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.52 ' CE2' HD22 ' A' 1004 ' ' LEU . 3.2 m-85 -74.99 -21.24 59.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.976 0.417 . . . . 0.0 110.67 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.657 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 81.5 tttt -66.79 -47.0 73.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.452 176.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.414 ' HE2' ' HA ' ' A' 1016 ' ' GLU . 65.6 pttt -73.65 -19.53 60.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.047 0.451 . . . . 0.0 110.719 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.31 -33.3 37.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.546 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 43.5 ttp -71.66 -39.89 70.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.27 174.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.84 -48.86 72.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.151 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -62.17 -33.29 74.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.406 0.622 . . . . 0.0 110.65 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -76.07 -36.2 59.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.884 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.546 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -61.48 -36.5 80.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.493 178.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' 1030 ' ' VAL . 60.2 t60 -63.3 -35.83 81.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.885 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.59 68.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.335 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.01 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.61 -30.66 67.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.281 0.563 . . . . 0.0 110.276 178.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.503 ' N ' HD23 ' A' 1028 ' ' LEU . . . -55.84 -40.23 72.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 170.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' 1026 ' ' HIS . 75.1 t -66.95 -33.47 63.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.035 175.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.568 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.2 p30 -70.73 -41.95 71.2 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.295 -177.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.8 66.84 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 171.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 60.1 tttp -59.52 -39.84 85.18 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.748 ' O ' HG23 ' A' 1038 ' ' VAL . 7.5 t30 -68.43 -49.11 62.31 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 121.05 0.453 . . . . 0.0 110.282 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 987' ' ' ALA . 3.3 tm? -67.54 -36.36 80.84 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.427 ' N ' HG11 ' A' ' 929' ' ' VAL . 5.2 tt -49.19 -44.11 42.79 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.321 0.649 . . . . 0.0 111.812 175.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' 1040 ' ' ASP . 24.3 t70 -89.0 -41.57 12.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.85 -176.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.971 HG12 ' HB2' ' A' ' 983' ' ' GLU . 3.3 t -74.26 -29.42 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' OE1' ' A' ' 983' ' ' GLU . 1.5 tt -81.14 -31.32 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.401 0.68 . . . . 0.0 110.302 170.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.486 ' HB3' ' O ' ' A' 1037 ' ' ASP . 35.3 t0 -52.78 -38.9 61.75 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 161.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' 1038 ' ' VAL . 48.0 mt-30 -76.27 -25.38 54.87 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.887 174.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.739 ' HB2' ' OE1' ' A' ' 983' ' ' GLU . . . -52.42 -56.31 15.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.709 1.141 . . . . 0.0 110.428 168.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.941 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 2.7 tpt180 -60.66 -29.77 69.48 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.464 178.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.5 tp -78.46 -25.36 45.84 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.37 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.598 ' HG3' ' CB ' ' A' ' 979' ' ' SER . 3.4 mptp? -62.23 -35.98 80.59 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.886 0.875 . . . . 0.0 109.504 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.77 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.7 tmt? -69.48 -42.31 74.98 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.223 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.483 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.9 mm -60.62 -31.75 49.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.719 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.8 m -64.79 -28.59 69.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.119 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 27.5 tt0 . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.947 0.403 . . . . 0.0 110.469 178.259 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.814 ' HD2' ' HB2' ' A' 1044 ' ' LEU . 15.0 ttt180 . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 121.089 0.471 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 3.0 t -111.31 29.27 7.96 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.447 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 48.27 59.45 4.28 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.738 -175.422 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.0 t70 -47.33 -173.54 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 O-C-N 125.631 1.832 . . . . 0.0 112.363 -176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.52 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.3 tmtp? -37.78 -25.05 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.374 1.07 . . . . 0.0 112.067 -177.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.722 ' HB ' HG13 ' A' 1039 ' ' ILE . 10.3 m -59.9 -49.79 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.059 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 62.2 t80 -75.93 -40.3 54.42 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.208 -178.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.96 -47.88 84.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.225 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.4 t-20 -72.18 -42.93 65.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.786 -173.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.66 ' CG2' HD11 ' A' 1039 ' ' ILE . 47.1 t -65.02 -30.17 49.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.676 178.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 51.8 m -60.85 -32.53 71.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.87 74.18 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.323 -1.308 . . . . 0.0 113.264 173.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.882 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.1 tt -61.78 -44.05 97.63 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 118.42 1.11 . . . . 0.0 108.314 175.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 937' ' ' ILE . 43.4 t -55.79 -44.1 76.26 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.1 mmpt? -61.58 -38.21 86.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.82 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.55 -25.58 38.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.893 -177.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.674 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.1 p -80.28 -15.58 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 C-N-CA 119.726 -0.789 . . . . 0.0 109.057 170.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 933' ' ' VAL . 20.5 mm -71.46 -35.37 56.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 166.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.633 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 70.4 mm-40 -52.85 -42.4 65.18 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.824 169.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.565 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 35.7 ttp -57.65 -46.69 83.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.485 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.582 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.4 p -72.75 -26.75 61.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.914 0.388 . . . . 0.0 110.979 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.489 ' HA ' ' NE2' ' A' ' 944' ' ' GLN . 20.2 m -78.82 -43.34 25.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.67 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.7 mmtp -54.58 -49.66 69.86 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.209 -1.814 . . . . 0.0 111.193 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.846 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.6 tt -65.57 -28.69 44.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 123.137 0.273 . . . . 0.0 111.599 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.793 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 69.1 mt-30 -50.06 -61.11 4.02 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 64.1 Cg_endo -97.78 16.73 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.562 1.508 . . . . 0.0 113.821 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.83 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -100.86 148.58 35.24 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -173.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 79.6 Cg_endo -86.4 -178.68 2.82 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.433 2.755 . . . . 0.0 110.231 165.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.864 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 10.0 Cg_endo -51.62 -34.63 53.78 Favored 'Trans proline' 0 C--O 1.249 1.057 0 C-N-CA 122.648 2.232 . . . . 0.0 112.73 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.534 ' O ' ' HD2' ' A' ' 953' ' ' PRO . 25.0 mt-10 -54.0 -39.05 65.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.018 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.83 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -95.83 2.42 53.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.864 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 21.0 m-30 -65.7 -38.56 89.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 172.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.983 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.34 -55.47 6.05 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 119.536 -0.866 . . . . 0.0 111.511 174.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.983 ' HD3' HG13 ' A' ' 952' ' ' VAL . 75.2 Cg_exo -51.02 -32.07 37.29 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 122.124 1.883 . . . . 0.0 115.166 173.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.846 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.9 ptt? -65.93 -45.18 82.8 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 121.502 -0.749 . . . . 0.0 110.157 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.698 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.8 t -69.94 -25.52 28.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.202 0.525 . . . . 0.0 110.022 173.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 61.0 tttm -61.2 -37.93 84.75 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.7 mm-40 -54.23 -44.61 71.87 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.494 172.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.7 t -65.57 -28.64 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.497 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.596 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.72 -43.45 51.32 Favored Glycine 0 C--N 1.328 0.131 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.561 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.4 mm? -62.74 -32.28 73.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 172.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.882 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -54.3 -56.13 21.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.012 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.785 HD11 HD13 ' A' ' 991' ' ' LEU . 61.1 tp -66.53 -36.47 82.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -58.11 -49.68 76.11 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.741 -0.599 . . . . 0.0 110.71 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 26.8 m -53.69 -35.78 61.47 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.124 173.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.717 HD11 ' HB2' ' A' ' 932' ' ' LEU . 7.2 mt -66.02 -38.03 87.41 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 120.847 0.356 . . . . 0.0 110.134 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.17 -32.65 37.04 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.203 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.41 -47.63 63.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.462 HG22 ' O ' ' A' ' 965' ' ' LEU . 6.8 t -69.56 -32.35 71.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.314 0.578 . . . . 0.0 110.109 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.923 HG13 HD11 ' A' ' 984' ' ' ILE . 45.5 t -55.5 -32.5 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.126 169.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.736 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 27.6 t70 -71.08 -25.38 62.6 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 120.636 0.255 . . . . 0.0 110.875 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 975' ' ' VAL . 5.4 mm-40 -65.52 -49.69 68.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.984 1.373 . . . . 0.0 108.408 169.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.587 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.2 t -65.87 -24.28 66.83 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 113.834 -1.53 . . . . 0.0 111.766 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.708 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.2 OUTLIER -61.58 -53.21 63.61 Favored Pre-proline 0 C--O 1.215 -0.761 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.791 -176.496 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 6.9 Cg_endo -54.77 -28.44 57.48 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 121.497 1.57 . . . . 0.0 111.584 168.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.71 -11.59 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.881 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.914 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -67.58 -51.97 29.2 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-O 118.965 -0.541 . . . . 0.0 111.316 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.578 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 32.5 Cg_exo -60.83 -33.01 93.37 Favored 'Trans proline' 0 C--N 1.363 1.297 0 C-N-CA 121.503 1.468 . . . . 0.0 110.715 173.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -60.13 -54.89 40.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.873 175.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.864 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -168.74 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.78 HG22 ' HB ' ' A' ' 984' ' ' ILE . 17.4 m -52.46 -20.2 2.72 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -170.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.914 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 19.1 p-80 -49.66 -22.19 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -171.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.24 -54.78 11.3 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.299 178.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.885 ' HB3' HG22 ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.14 -41.82 40.3 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 179.372 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.923 HD11 HG13 ' A' ' 969' ' ' VAL . 10.8 tp -60.87 -30.6 47.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.395 -171.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.87 -42.82 60.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.173 174.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.596 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 18.1 ptp -64.34 -52.83 56.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -173.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.839 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -75.94 -35.57 59.66 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.61 -174.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.573 ' NE2' HG13 ' A' ' 984' ' ' ILE . 32.9 mt-30 -57.97 -54.98 40.83 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.815 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -57.89 -36.6 72.64 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.802 0.81 . . . . 0.0 109.454 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.616 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 14.0 tp -60.63 -62.06 2.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.963 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.995 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 1.3 pp -73.1 -23.23 60.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -172.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.501 ' N ' HD12 ' A' ' 991' ' ' LEU . 24.2 t-20 -64.69 -35.66 81.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 23.7 m -76.04 -36.83 58.93 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.886 -178.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.05 -32.77 13.66 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.323 -171.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.025 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.7 tm? -58.46 -38.0 76.62 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.469 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -67.72 -41.17 83.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.631 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 6.9 mm-40 -53.61 -44.3 69.34 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.3 172.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.572 ' HB3' ' CG1' ' A' ' 955' ' ' VAL . 4.2 mm? -69.56 -29.31 66.84 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.981 178.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.722 ' O ' ' HG2' ' A' 1002 ' ' MET . 43.8 mt -61.14 -45.5 98.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 174.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.631 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 2.9 p30 -82.91 -15.26 52.1 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.985 -0.447 . . . . 0.0 111.292 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.62 ' HA ' ' CB ' ' A' 1004 ' ' LEU . 66.1 mttm -86.37 -26.58 24.74 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.478 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.869 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 21.1 ptt? -73.93 -34.24 64.26 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.922 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.6 ttpt -73.91 -18.03 60.96 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 113.324 -1.762 . . . . 0.0 109.573 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.62 ' CB ' ' HA ' ' A' 1001 ' ' LYS . 35.9 tp -85.84 -54.72 4.34 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.178 0.924 . . . . 0.0 110.646 -173.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.22 -38.62 83.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.263 0.554 . . . . 0.0 109.848 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -23.92 54.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.059 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.922 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.9 tp-100 -69.89 -42.16 73.79 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.355 0.598 . . . . 0.0 109.75 177.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.483 177.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? . . . . . 0 C--O 1.233 0.23 0 CA-C-O 120.492 0.187 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.5 -37.06 74.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.561 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -50.09 -39.84 43.74 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.775 0.321 . . . . 0.0 111.673 173.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 5.6 m-30 -84.89 -24.0 28.68 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.831 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.494 ' HB2' HE22 ' A' 1014 ' ' GLN . 76.1 tttt -69.74 -44.47 70.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.826 0.346 . . . . 0.0 110.401 174.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -57.95 -57.47 12.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.475 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -57.04 -37.21 71.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.71 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.474 ' HE2' ' HA ' ' A' 1018 ' ' LYS . 40.5 ttp -64.73 -42.15 95.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.802 0.335 . . . . 0.0 110.934 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.1 tp -66.06 -41.7 90.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.943 0.402 . . . . 0.0 110.72 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 4.5 m -65.42 -30.08 70.85 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.856 0.836 . . . . 0.0 109.99 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.442 ' C ' HD21 ' A' ' 998' ' ' LEU . . . -78.91 -40.08 33.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.695 -1.138 . . . . 0.0 109.91 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.518 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.63 ' O ' HG23 ' A' 1030 ' ' VAL . 15.2 t-80 -65.13 -38.22 89.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.81 -46.79 74.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.209 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.025 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.87 -32.58 73.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 109.988 179.566 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.626 ' N ' HD23 ' A' 1028 ' ' LEU . . . -60.52 -33.96 73.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.475 170.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' 1026 ' ' HIS . 85.9 t -75.82 -32.45 23.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 109.828 177.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.995 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 7.5 m-20 -59.34 -44.43 92.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.237 172.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.591 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -58.2 -52.97 63.34 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.793 170.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 1.6 tmtp? -53.47 -38.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.276 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.611 ' O ' HG23 ' A' 1038 ' ' VAL . 66.5 t30 -71.88 -39.89 69.31 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.911 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.793 HD22 HD21 ' A' ' 991' ' ' LEU . 17.1 tp -74.23 -29.52 61.74 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 121.279 -0.168 . . . . 0.0 110.657 -176.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.641 ' HB3' ' CG1' ' A' ' 929' ' ' VAL . 4.7 pp -70.5 -26.66 63.7 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.35 -39.68 38.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 174.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.885 HG22 ' HB3' ' A' ' 983' ' ' GLU . 19.5 t -51.77 -56.15 6.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.163 174.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.722 HG13 ' HB ' ' A' ' 925' ' ' VAL . 20.5 pt -94.24 -26.48 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -170.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.632 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 2.8 t0 -55.25 -42.63 73.72 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.511 162.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.673 ' O ' ' HG2' ' A' 1045 ' ' LYS . 21.8 mt-30 -77.61 -22.67 50.45 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.676 175.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.52 -50.79 64.69 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.055 0.455 . . . . 0.0 110.463 169.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.688 ' HG2' HG21 ' A' ' 925' ' ' VAL . 16.8 mmt180 -54.73 -38.12 66.74 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.093 0.473 . . . . 0.0 110.434 172.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.814 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 56.9 tp -69.48 -28.39 66.04 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.286 174.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.864 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 24.5 mmtp -67.84 -40.9 83.66 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.861 0.839 . . . . 0.0 109.133 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 26.6 ttt -59.23 -46.44 88.47 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.161 -1.381 . . . . 0.0 108.889 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.9 -50.8 78.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.011 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.1 m -41.84 -47.96 4.28 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.3 tt0 . . . . . 0 C--N 1.327 -0.409 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.744 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.72 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 8.4 tpt180 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.408 ' HB3' ' O ' ' A' ' 920' ' ' ARG . 22.7 t 76.88 26.96 0.75 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.393 0.616 . . . . 0.0 110.054 -173.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 46.93 69.79 0.46 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.706 168.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.5 t70 -47.05 -174.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.648 -1.615 . . . . 0.0 112.67 -178.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.402 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 1.2 tmtp? -40.12 -23.05 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.998 0.919 . . . . 0.0 112.169 -177.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.672 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 7.5 m -56.36 -50.28 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 172.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.506 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 7.6 t80 -75.08 -29.75 60.76 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.011 0.91 . . . . 0.0 108.8 -176.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.37 -56.22 9.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.615 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.423 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.81 -38.75 76.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.677 -175.636 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.936 ' HB ' HD11 ' A' 1039 ' ' ILE . 9.5 p -60.41 -34.13 56.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.904 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 93.4 m -69.1 -35.66 76.71 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.47 -28.03 61.7 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.618 174.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.916 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.1 tt -66.83 -46.8 73.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 937' ' ' ILE . 17.7 t -59.59 -39.85 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.165 176.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.666 ' O ' HG12 ' A' ' 937' ' ' ILE . 10.0 mmpt? -70.3 -19.03 63.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.102 0.477 . . . . 0.0 110.435 177.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.728 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.63 -25.33 33.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.92 0.39 . . . . 0.0 110.623 175.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.587 ' O ' ' HB3' ' A' ' 939' ' ' MET . 11.1 p -86.41 -10.09 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.927 172.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 934' ' ' LYS . 5.6 pt -83.48 -27.24 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 165.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.3 mt-10 -57.64 -39.29 76.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 164.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.613 ' HG2' ' SD ' ' A' ' 954' ' ' MET . 1.7 tmt? -57.07 -45.6 83.13 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.054 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 21.0 m -67.65 -30.06 69.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.99 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.1 m -79.62 -46.67 16.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.995 0.902 . . . . 0.0 108.677 -175.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.56 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 3.3 tmtm? -56.86 -45.61 82.35 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.366 -1.743 . . . . 0.0 110.786 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.1 tt -67.69 -30.34 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 O-C-N 123.302 0.376 . . . . 0.0 111.772 -176.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.803 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.4 mt-30 -50.09 -60.01 5.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.762 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 77.5 Cg_endo -97.37 34.8 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.513 1.475 . . . . 0.0 112.935 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -120.43 141.37 31.88 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 86.7 Cg_endo -88.7 -179.33 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 123.19 2.593 . . . . 0.0 109.718 165.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.638 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 9.1 Cg_endo -50.87 -32.37 37.24 Favored 'Trans proline' 0 C--O 1.247 0.932 0 C-N-CA 122.5 2.134 . . . . 0.0 112.451 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.6 -43.7 72.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.962 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.675 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.8 mp0 -95.71 1.72 53.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.537 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.638 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 5.9 m-30 -61.01 -48.25 82.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.519 -0.473 . . . . 0.0 109.786 176.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.027 HG13 ' HD3' ' A' ' 953' ' ' PRO . 1.3 p -75.72 -42.71 3.86 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.294 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.027 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.5 Cg_exo -52.68 -30.69 47.08 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.459 2.106 . . . . 0.0 113.753 168.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 33.8 ttp -56.88 -54.13 50.03 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 122.119 0.962 . . . . 0.0 109.189 174.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.537 HG11 ' HA ' ' A' ' 999' ' ' ILE . 42.0 t -60.64 -28.17 42.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.33 172.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 82.0 tttt -59.37 -38.28 80.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.485 ' OE1' ' HB3' ' A' ' 938' ' ' GLU . 38.9 mt-10 -59.11 -46.0 89.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.248 176.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.841 HG21 HD21 ' A' 1028 ' ' LEU . 10.0 p -75.11 -22.08 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 120.116 -0.633 . . . . 0.0 111.416 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.424 ' HA2' ' CD1' ' A' ' 995' ' ' LEU . . . -71.89 -43.83 48.72 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.646 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.78 -23.69 65.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.025 0.44 . . . . 0.0 110.732 172.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.42 -55.67 30.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.846 175.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.548 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 35.0 tp -64.37 -35.02 79.52 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.165 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 10.2 tpt180 -55.07 -57.73 10.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.187 0.518 . . . . 0.0 111.195 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 12.7 m -57.34 -38.14 73.65 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 110.646 175.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.799 HD21 HD23 ' A' 1035 ' ' LEU . 56.1 tp -64.64 -28.07 69.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.069 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.447 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 54.2 tp -62.29 -33.19 74.18 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.69 93.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.198 0.523 . . . . 0.0 110.034 172.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.672 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.8 m -67.59 -37.91 83.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.882 173.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 965' ' ' LEU . 93.8 t -56.47 -30.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.204 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.606 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.4 t70 -77.64 -22.29 50.93 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.429 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.633 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 41.8 mm-40 -71.82 -50.41 29.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 122.718 1.247 . . . . 0.0 108.499 170.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.635 ' OG ' HG21 ' A' ' 980' ' ' THR . 47.8 t -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.685 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.757 ' HA ' HD23 ' A' ' 976' ' ' LEU . 7.4 tt -60.87 -54.39 54.86 Favored Pre-proline 0 C--O 1.213 -0.827 0 CA-C-O 118.445 -0.788 . . . . 0.0 112.156 -176.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 38.0 Cg_exo -59.5 -27.49 85.09 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 121.613 1.612 . . . . 0.0 110.486 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.1 t -75.72 -14.2 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.982 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.954 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.6 pp -76.81 -41.98 2.77 Favored Pre-proline 0 CA--C 1.539 0.529 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.762 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.954 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 17.2 Cg_exo -69.03 -28.98 28.09 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.068 1.417 . . . . 0.0 110.118 172.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.32 -55.75 28.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.23 171.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.838 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 38.6 m -162.7 -42.04 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.833 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 93.6 m -51.53 -26.99 9.52 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -171.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.721 ' HA ' HG22 ' A' ' 984' ' ' ILE . 11.6 p80 -50.97 -39.12 54.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.1 0.864 . . . . 0.0 112.723 -165.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.4 mtm180 -53.73 -50.85 65.04 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.537 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.831 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.7 -48.35 32.73 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.841 -178.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.721 HG22 ' HA ' ' A' ' 981' ' ' HIS . 9.7 tp -60.4 -30.2 45.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.162 -174.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.65 -35.86 75.57 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.027 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.669 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 15.6 ptm -66.78 -52.69 41.12 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.455 -176.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.711 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -80.41 -44.75 18.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -174.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.474 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -64.24 -35.29 80.32 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.033 -173.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -66.11 -42.49 89.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.415 0.626 . . . . 0.0 109.515 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -49.56 75.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.261 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.645 HD21 HD22 ' A' 1035 ' ' LEU . 2.4 pp -73.92 -29.39 62.02 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -173.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.524 ' N ' HD12 ' A' ' 991' ' ' LEU . 6.8 t30 -57.81 -43.34 85.65 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 m -76.6 -25.21 53.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.92 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -101.29 -45.56 5.3 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -172.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.935 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.31 -52.7 62.6 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.334 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.53 -43.99 80.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.517 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' 1001 ' ' LYS . 62.1 tt0 -54.23 -41.06 68.27 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.548 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.647 HD12 ' HB3' ' A' 1001 ' ' LYS . 46.0 tp -70.05 -31.22 68.73 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.693 -175.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' 1003 ' ' LYS . 59.3 mt -58.96 -35.05 54.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.332 0.586 . . . . 0.0 109.862 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.452 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 35.5 m-80 -95.66 -10.16 30.12 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.771 178.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.647 ' HB3' HD12 ' A' ' 998' ' ' LEU . 27.1 tptt -82.75 -48.4 10.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.594 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 7.8 tpt -79.58 -26.39 41.32 Favored 'General case' 0 N--CA 1.438 -1.037 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.223 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.715 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.5 tttm -56.16 -48.96 75.31 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 168.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.449 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 31.7 tp -58.31 -43.73 88.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.351 174.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -64.16 -42.08 96.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.05 0.452 . . . . 0.0 110.926 178.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.54 -12.54 60.04 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.218 177.231 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.715 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.3 tp-100 -85.09 -23.27 28.57 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.563 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.479 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.042 176.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.461 0.103 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -60.3 -37.4 80.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.809 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' 1020 ' ' GLN . 15.0 tp10 -50.78 -50.38 56.19 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.673 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.479 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.32 -25.57 61.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.792 0.33 . . . . 0.0 111.445 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' 1021 ' ' MET . 62.1 tttm -70.2 -36.04 74.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.319 0.581 . . . . 0.0 109.848 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 78.2 tttt -65.82 -29.75 70.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.267 174.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' 1016 ' ' GLU . 79.1 mt-30 -83.84 -38.33 21.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.992 -176.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -71.59 -25.94 62.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.854 177.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.9 tm? -64.82 -42.18 95.17 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 16.7 m -58.91 -35.55 73.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.452 176.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' 1001 ' ' LYS . . . -79.06 -38.82 35.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.441 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -61.69 -32.65 72.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.098 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.512 ' O ' HG23 ' A' 1030 ' ' VAL . 77.9 t60 -72.9 -40.89 65.18 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.151 176.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.28 -37.6 87.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.204 0.526 . . . . 0.0 109.851 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.935 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -60.2 -50.33 74.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.583 173.568 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.11 70.38 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.374 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' 1026 ' ' HIS . 97.5 t -65.75 -33.15 61.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.689 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.81 -39.32 73.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.857 -0.737 . . . . 0.0 109.948 -177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.793 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.15 -53.69 51.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.54 170.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.813 ' HA ' HD23 ' A' 1036 ' ' LEU . 96.9 mttt -63.77 -32.47 73.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -175.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' 1038 ' ' VAL . 7.0 t30 -69.79 -36.88 76.07 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.006 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.799 HD23 HD21 ' A' ' 965' ' ' LEU . 13.6 tp -77.65 -24.17 49.51 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.486 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.891 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.5 OUTLIER -59.42 -43.76 93.0 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' 1041 ' ' GLN . 33.6 t70 -73.94 -22.6 59.6 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.217 177.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.831 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 15.1 t -76.89 -46.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.855 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.936 HD11 ' HB ' ' A' ' 929' ' ' VAL . 8.0 pt -92.62 -31.69 4.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -175.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.578 ' HB3' ' O ' ' A' 1036 ' ' LEU . 0.5 OUTLIER -54.1 -48.43 70.71 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 163.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.645 ' HG2' HD12 ' A' 1044 ' ' LEU . 25.1 mt-30 -75.37 -22.33 57.6 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 115.063 -0.972 . . . . 0.0 111.201 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.712 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.4 -52.75 62.53 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.382 0.611 . . . . 0.0 110.255 165.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.748 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 1.2 mpt_? -59.39 -28.26 66.73 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.74 173.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.645 HD12 ' HG2' ' A' 1041 ' ' GLN . 84.0 mt -78.76 -23.37 45.38 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.108 173.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.838 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 48.6 mmtm -63.28 -36.21 82.93 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 2.0 tmt? -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.268 176.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.5 -38.93 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.685 172.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.7 m -64.53 -41.45 96.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.601 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.057 -178.691 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB2' HG13 ' A' 1047 ' ' ILE . 3.8 tpt180 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 29.9 m -85.49 27.62 0.82 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.629 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.61 68.76 0.78 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.862 0.865 . . . . 0.0 112.148 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.747 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.3 t70 -47.68 -171.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.497 -2.138 . . . . 0.0 112.511 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.0 tmtm? -27.92 -26.9 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.16 1.384 . . . . 0.0 113.8 177.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.846 HG21 ' HB2' ' A' 1043 ' ' ARG . 3.9 m -57.33 -52.65 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 174.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -77.28 -26.21 52.15 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 34.0 mt-10 -66.79 -62.28 1.53 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.761 -1.108 . . . . 0.0 112.097 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.483 ' HB2' ' CD ' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.91 -32.53 67.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.788 -0.187 . . . . 0.0 111.141 -172.452 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.952 HG11 ' HA ' ' A' 1036 ' ' LEU . 10.7 p -61.38 -31.76 51.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.888 175.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.574 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.6 m -63.46 -38.08 89.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 169.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . 0.455 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -59.09 -27.63 62.78 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.865 173.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.953 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 15.7 tp -66.03 -34.35 77.88 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.607 ' O ' HG12 ' A' ' 937' ' ' ILE . 57.7 t -77.01 -37.7 26.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.293 173.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.5 mmpt? -58.85 -37.57 76.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.155 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 1.116 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.1 -24.64 40.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.708 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.589 HG12 ' HA ' ' A' ' 933' ' ' VAL . 14.5 p -79.47 -15.33 13.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.045 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 933' ' ' VAL . 44.1 mm -74.62 -38.53 45.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 165.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.655 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 19.2 mm-40 -52.45 -46.28 66.39 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 167.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.607 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 29.3 ttp -58.32 -37.0 74.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.667 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.59 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 46.1 m -74.29 -37.96 63.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.625 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.503 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 28.3 m -78.82 -44.27 23.43 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.979 0.895 . . . . 0.0 109.452 -175.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.717 ' HD2' ' HB2' ' A' ' 954' ' ' MET . 4.5 tmtm? -59.89 -34.75 73.58 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.383 -178.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.553 HD12 ' HE1' ' A' ' 954' ' ' MET . 7.6 tt -77.35 -24.99 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 O-C-N 123.0 0.187 . . . . 0.0 111.143 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.743 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 87.1 mm-40 -51.39 -55.65 27.18 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.575 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.743 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.8 Cg_endo -99.89 31.59 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.148 1.899 . . . . 0.0 112.697 175.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -102.87 126.27 33.09 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -172.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.412 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 67.7 Cg_endo -77.26 171.88 17.0 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.75 2.3 . . . . 0.0 109.298 160.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.569 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 6.3 Cg_endo -50.01 -38.71 49.76 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 122.581 2.188 . . . . 0.0 112.689 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.06 -23.95 65.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.668 ' HB3' ' HE3' ' A' ' 942' ' ' LYS . 20.4 mm-40 -102.39 -15.66 16.46 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.327 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB2' ' HG3' ' A' 1006 ' ' GLN . 26.8 m-85 -55.03 -51.44 66.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.295 0.569 . . . . 0.0 109.644 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -66.91 -42.75 44.69 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.728 -178.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 73.8 Cg_exo -58.26 -35.1 99.04 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 121.639 1.559 . . . . 0.0 113.555 168.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.717 ' HB2' ' HD2' ' A' ' 942' ' ' LYS . 0.3 OUTLIER -62.44 -50.19 72.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.865 0.84 . . . . 0.0 109.737 177.492 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.615 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -60.41 -26.32 36.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.22 172.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 2.6 ttpm? -66.37 -35.16 79.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.8 mm-40 -56.51 -46.73 80.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.049 178.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.568 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 12.2 p -69.71 -22.64 25.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.957 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.417 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -69.24 -43.31 71.7 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.116 -1.04 . . . . 0.0 111.507 175.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.83 -22.2 65.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 111.067 172.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 1.116 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -63.47 -57.63 9.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.251 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 965' ' ' LEU . 16.9 tp -68.82 -32.55 72.33 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.495 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -57.48 -60.5 3.55 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.427 HG22 ' OD1' ' A' ' 928' ' ' ASN . 22.5 m -55.31 -34.8 64.48 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.848 0.832 . . . . 0.0 110.293 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 962' ' ' LEU . 2.6 tm? -64.52 -28.73 69.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.577 176.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 85.8 mt -67.5 -28.96 68.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.612 0.244 . . . . 0.0 110.654 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.56 -42.91 98.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.439 0.638 . . . . 0.0 109.497 172.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.783 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.8 m -62.36 -40.04 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.927 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.844 HG13 HD11 ' A' ' 984' ' ' ILE . 54.4 t -55.62 -31.26 28.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.197 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.563 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.0 t70 -74.46 -22.42 59.11 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.636 0.255 . . . . 0.0 110.97 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.63 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 59.6 mm-40 -71.95 -46.53 57.12 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 122.635 1.207 . . . . 0.0 109.317 169.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.438 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 28.5 t -66.32 -24.64 66.57 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.59 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.625 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.0 tp -60.57 -50.14 86.81 Favored Pre-proline 0 C--O 1.22 -0.498 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.248 -177.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.63 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.6 Cg_exo -58.12 -28.27 83.06 Favored 'Trans proline' 0 C--N 1.358 1.062 0 CA-C-N 121.02 1.4 . . . . 0.0 110.868 169.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.612 HG11 ' O ' ' A' 1042 ' ' ALA . 40.9 t -74.45 -15.76 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.547 176.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.767 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 2.2 tt -67.92 -52.72 23.24 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.157 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 35.8 Cg_exo -61.62 -29.07 83.52 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.155 1.237 . . . . 0.0 110.719 172.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -66.52 -59.39 3.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.392 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.557 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 68.8 m -163.9 -39.03 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -173.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 976' ' ' LEU . 2.0 t -62.11 -16.14 50.36 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -169.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.767 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 35.7 t60 -48.44 -21.55 0.57 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.806 0.443 . . . . 0.0 112.073 -177.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 11.1 tpp180 -77.66 -54.36 6.47 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.324 0.583 . . . . 0.0 110.379 176.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.887 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.65 -46.54 25.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.312 -176.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.844 HD11 HG13 ' A' ' 969' ' ' VAL . 12.6 tt -57.8 -32.96 44.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.228 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.58 -35.26 67.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.363 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.716 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.1 ptp -61.53 -61.5 2.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.746 -176.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.726 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.42 -34.94 31.24 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.504 ' NE2' HG11 ' A' ' 969' ' ' VAL . 45.2 tt0 -64.05 -47.76 78.91 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.59 0.632 . . . . 0.0 111.25 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -68.56 -27.9 66.48 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.529 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 7.3 tp -63.65 -42.99 98.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.857 176.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.726 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 92.6 mt -68.13 -31.29 70.78 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.035 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -56.4 -47.18 79.51 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -31.42 58.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.715 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.568 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.7 p30 -91.37 -52.09 4.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 120.069 -0.652 . . . . 0.0 112.435 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.039 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.05 -52.03 59.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.7 87.78 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.18 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 7.8 pt-20 -65.11 -32.6 74.38 Favored 'General case' 0 C--O 1.212 -0.909 0 C-N-CA 119.164 -1.015 . . . . 0.0 110.581 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.683 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 3.0 mm? -66.38 -41.86 88.77 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.647 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.506 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.3 mt -52.99 -40.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.981 173.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.508 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 51.3 m-20 -88.41 -10.07 50.49 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.343 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.683 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -85.77 -39.26 17.32 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.786 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.691 ' SD ' ' HD2' ' A' ' 951' ' ' TYR . 0.1 OUTLIER -78.72 -36.57 43.16 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 174.601 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.692 ' O ' ' HB2' ' A' 1007 ' ' GLN . 76.0 tttt -60.48 -52.48 65.02 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.139 173.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 13.7 mt -57.47 -41.17 80.11 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 174.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.796 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -61.62 -45.8 92.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 0.0 110.496 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.739 ' HG3' ' HB2' ' A' ' 951' ' ' TYR . 11.7 mm-40 -77.63 -9.55 59.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.733 0.778 . . . . 0.0 110.34 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.692 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.4 OUTLIER -87.55 -5.31 58.82 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.256 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 79.5 t80 . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.784 179.605 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.503 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -60.88 -37.73 83.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.482 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -49.88 -50.03 47.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 173.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.796 ' HD2' ' HA ' ' A' 1005 ' ' ALA . 1.1 m-30 -71.04 -28.15 64.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.559 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.503 ' HB2' HE22 ' A' 1014 ' ' GLN . 28.8 ttpp -74.86 -25.12 58.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.207 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 46.4 tttp -65.86 -61.0 2.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.173 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.03 -41.83 26.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.759 168.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.625 ' HG3' ' HE3' ' A' 1002 ' ' MET . 1.8 tmt? -63.42 -44.64 94.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.837 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 50.8 tp -60.5 -37.66 81.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.779 0.324 . . . . 0.0 111.42 -177.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 25.9 m -68.93 -31.77 70.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.573 0.702 . . . . 0.0 110.15 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.403 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -79.25 -39.26 33.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.86 -178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.455 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -63.84 -36.28 83.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.758 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 63.6 t60 -66.52 -31.16 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.493 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.94 -50.54 55.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.375 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.039 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.97 -32.07 73.07 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.15 0.5 . . . . 0.0 109.755 -175.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.63 ' N ' HD23 ' A' 1028 ' ' LEU . . . -61.69 -44.84 96.17 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.091 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 64.5 t -77.25 -18.99 14.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.547 ' C ' HD21 ' A' ' 991' ' ' LEU . 69.3 m-20 -85.73 -34.42 21.23 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.702 176.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.633 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -53.83 -49.14 69.06 Favored 'General case' 0 C--N 1.345 0.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 161.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.763 ' HA ' HD23 ' A' 1036 ' ' LEU . 56.8 tttm -61.14 -28.38 69.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.638 177.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.587 ' O ' HG23 ' A' 1038 ' ' VAL . 67.2 t30 -74.74 -34.32 62.5 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.9 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.705 ' CD2' HD11 ' A' ' 965' ' ' LEU . 25.1 tp -78.09 -23.69 47.86 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.688 -177.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.952 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.2 pp -63.6 -43.27 97.39 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.415 ' N ' HD12 ' A' 1036 ' ' LEU . 16.5 t70 -62.68 -43.73 98.05 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.101 175.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.887 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 44.2 t -53.4 -69.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.575 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.931 HD11 ' HB ' ' A' ' 929' ' ' VAL . 7.1 pt -77.94 -26.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.2 t70 -49.94 -48.21 52.05 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 163.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.424 ' O ' ' N ' ' A' 1045 ' ' LYS . 27.1 mt-30 -78.72 -24.54 44.87 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.192 177.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.719 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.88 -56.01 24.16 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 118.921 0.782 . . . . 0.0 111.537 171.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.846 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.0 OUTLIER -55.68 -30.38 60.97 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.564 176.194 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 41.6 tp -74.77 -37.27 62.49 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.591 172.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 13.6 mptt -53.68 -38.98 64.74 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.018 0.927 . . . . 0.0 109.869 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.8 ttt -60.54 -44.59 95.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.583 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 920' ' ' ARG . 43.3 mm -70.52 -28.7 35.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.448 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 67.8 m -58.9 -54.65 44.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.412 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.34 0.591 . . . . 0.0 110.114 178.812 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.871 ' HD3' ' HB2' ' A' 1044 ' ' LEU . 2.0 ttt-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 43.5 t 62.66 10.3 4.07 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 122.703 0.401 . . . . 0.0 111.695 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 46.02 52.74 9.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 123.364 0.666 . . . . 0.0 110.85 -176.146 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.485 ' O ' ' N ' ' A' ' 925' ' ' VAL . 9.4 t70 -45.58 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 125.817 1.948 . . . . 0.0 112.182 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.6 tmtp? -44.82 -14.18 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.515 0.726 . . . . 0.0 111.722 -178.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.833 ' HA ' HG23 ' A' ' 968' ' ' THR . 9.8 m -63.15 -53.3 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.15 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.573 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 59.2 t80 -77.62 -28.35 51.43 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.661 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.6 mt-10 -62.71 -66.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.175 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.525 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.5 t30 -66.71 -36.17 81.85 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.264 -172.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.861 ' HA ' HD13 ' A' ' 932' ' ' LEU . 9.9 p -61.66 -39.48 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 120.932 0.396 . . . . 0.0 111.339 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.564 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 59.9 m -66.24 -33.36 75.57 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.26 -30.04 60.76 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 114.55 -1.204 . . . . 0.0 112.757 172.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 1.041 HD11 ' HB2' ' A' ' 965' ' ' LEU . 6.9 mp -63.04 -45.85 90.33 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 117.941 0.871 . . . . 0.0 109.622 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 936' ' ' VAL . 61.8 t -63.21 -37.34 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.648 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -68.4 -31.57 71.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.209 0.528 . . . . 0.0 110.373 175.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -77.56 -25.32 49.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.563 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -81.3 -6.71 10.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 119.714 -0.794 . . . . 0.0 109.34 172.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.564 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 66.1 mt -75.91 -33.75 26.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 165.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 24.6 mm-40 -53.24 -40.7 64.79 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.66 168.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.918 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.5 tmm? -58.12 -46.9 84.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.941 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.601 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 46.9 m -64.08 -33.08 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.201 179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.716 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 13.3 m -77.46 -45.49 25.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.953 0.882 . . . . 0.0 108.938 -176.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.554 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 8.5 mmtp -55.94 -47.1 78.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.063 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.615 ' HA ' ' OE1' ' A' ' 950' ' ' GLU . 10.9 tt -68.89 -28.89 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.515 -174.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.625 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 75.8 mt-30 -53.28 -62.03 4.12 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.716 ' HD3' ' O ' ' A' ' 941' ' ' SER . 5.7 Cg_exo -77.64 -35.69 1.44 Allowed 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.703 1.602 . . . . 0.0 114.88 -170.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.441 ' HB3' ' CG ' ' A' ' 950' ' ' GLU . . . -105.92 164.21 15.47 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -167.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.642 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 10.8 Cg_exo -74.26 179.99 5.29 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 123.845 3.03 . . . . 0.0 110.94 169.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.69 -15.56 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 124.134 3.223 . . . . 0.0 115.323 -171.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 7.0 pt-20 -57.72 -20.07 31.91 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.395 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.642 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.2 OUTLIER -87.78 -22.01 24.78 Favored 'General case' 0 CA--C 1.511 -0.524 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.659 174.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.712 ' HD2' ' HA ' ' A' 1002 ' ' MET . 0.3 OUTLIER -56.22 -50.47 71.18 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 123.814 0.697 . . . . 0.0 110.245 -172.246 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.993 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -75.11 -45.04 4.74 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.635 178.574 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.993 ' HD3' HG13 ' A' ' 952' ' ' VAL . 85.4 Cg_exo -56.74 -27.49 71.3 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 121.599 1.532 . . . . 0.0 114.731 172.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.918 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 26.4 ptt? -74.61 -35.68 62.94 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.758 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 1.053 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -63.21 -27.49 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.473 170.543 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.72 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.7 ttpp -56.07 -41.73 75.55 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.1 mm-40 -58.26 -46.25 86.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.36 -1.291 . . . . 0.0 111.558 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.563 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.3 m -74.36 -28.46 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.8 -42.35 38.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.048 -1.073 . . . . 0.0 111.861 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 57.2 tp -58.61 -34.52 71.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.244 0.545 . . . . 0.0 109.595 171.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.61 -48.42 81.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.736 174.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 17.9 tp -68.7 -36.85 78.99 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.726 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 46.6 ttp180 -63.77 -47.9 79.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.605 -0.684 . . . . 0.0 111.595 176.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 p -56.81 -35.7 69.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.318 0.58 . . . . 0.0 109.869 171.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 1.041 ' HB2' HD11 ' A' ' 932' ' ' LEU . 63.7 tp -64.41 -34.51 78.34 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.84 176.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 88.5 mt -58.25 -33.82 69.79 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.099 178.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.4 -43.06 91.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.63 0.728 . . . . 0.0 109.647 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.833 HG23 ' HA ' ' A' ' 925' ' ' VAL . 6.2 m -60.29 -43.4 96.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.861 173.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.568 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 76.3 t -55.3 -35.99 38.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.905 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.654 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 16.2 t70 -71.63 -22.33 61.71 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 120.504 0.193 . . . . 0.0 111.447 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 975' ' ' VAL . 7.2 mm-40 -70.06 -47.87 60.18 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 122.838 1.304 . . . . 0.0 108.379 170.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.625 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.7 t -67.83 -25.44 65.56 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.657 -1.611 . . . . 0.0 111.67 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.631 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.6 mt -63.16 -51.34 70.38 Favored Pre-proline 0 C--O 1.218 -0.579 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.654 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.6 Cg_endo -57.48 -29.42 84.64 Favored 'Trans proline' 0 C--N 1.352 0.762 0 CA-C-N 121.594 1.605 . . . . 0.0 110.729 169.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' 1042 ' ' ALA . 2.5 t -76.76 -11.29 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 119.899 -0.721 . . . . 0.0 110.885 175.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.631 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.2 tt -65.19 -56.08 22.22 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.796 176.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 976' ' ' LEU . 31.5 Cg_exo -60.5 -31.99 93.11 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 121.297 1.331 . . . . 0.0 110.628 174.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.05 -53.06 61.82 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.315 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.779 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.3 m -169.33 -38.32 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.699 HG22 ' HB ' ' A' ' 984' ' ' ILE . 5.5 m -57.04 -17.42 10.07 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.593 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 13.7 p-80 -48.6 -18.84 0.28 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -77.62 -54.89 5.85 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.059 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.056 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.8 OUTLIER -79.84 -44.21 20.93 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.315 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.699 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -59.25 -33.33 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -173.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.37 -36.05 68.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.661 174.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptm -67.34 -56.24 10.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.78 -176.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.576 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.66 -39.94 23.61 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 1.071 ' HA ' HD12 ' A' ' 991' ' ' LEU . 25.0 tm0? -67.47 -38.99 85.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.688 -173.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -72.5 -24.67 61.19 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.479 0.657 . . . . 0.0 109.268 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.4 tp -72.79 -41.13 65.3 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.561 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.071 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.5 mt -59.01 -50.51 73.82 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.216 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.42 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 27.9 t-20 -55.5 -38.83 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.818 -178.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -67.51 -38.77 84.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.408 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.703 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -113.31 -30.13 7.01 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -170.669 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.082 ' HA ' HD12 ' A' 1028 ' ' LEU . 4.2 mm? -55.95 -51.16 68.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 166.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.767 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -60.65 -44.33 96.54 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.582 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.597 ' HG3' ' HE2' ' A' 1001 ' ' LYS . 6.3 tp10 -51.97 -42.93 63.29 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.983 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.695 ' O ' ' HG2' ' A' 1002 ' ' MET . 3.8 mm? -70.94 -33.1 70.17 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.568 -175.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.777 ' HA ' HG11 ' A' ' 955' ' ' VAL . 8.2 pt -62.65 -23.57 33.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.095 177.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.745 ' O ' ' HB2' ' A' 1004 ' ' LEU . 17.0 m-80 -94.52 -10.3 32.64 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.262 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.597 ' HE2' ' HG3' ' A' ' 997' ' ' GLU . 73.0 mmtt -83.36 -40.14 19.81 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.053 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 8.6 mmt -70.81 -44.2 67.06 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.732 ' O ' ' HB2' ' A' 1007 ' ' GLN . 86.2 tttt -57.62 -45.69 85.07 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.464 173.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.745 ' HB2' ' O ' ' A' 1000 ' ' ASN . 17.0 tp -55.09 -53.53 54.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.454 0.702 . . . . 0.0 112.824 172.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.25 -41.74 93.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.077 0.465 . . . . 0.0 110.58 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.06 -18.05 59.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.555 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.732 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.4 tp-100 -75.94 -41.03 52.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.362 178.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.59 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.354 176.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.574 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? . . . . . 0 CA--C 1.523 -0.065 0 CA-C-O 120.795 0.331 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.577 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 1.6 mp0 -61.7 -33.37 73.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.765 -176.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.73 -47.75 50.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.682 0.277 . . . . 0.0 111.232 169.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.625 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.9 m-30 -76.12 -22.09 55.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.195 0.521 . . . . 0.0 110.508 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.685 ' HG3' ' OH ' ' A' ' 951' ' ' TYR . 75.7 tttt -73.03 -41.81 63.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.164 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.84 -18.64 61.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.962 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -77.24 -40.57 44.33 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' SD ' ' A' 1002 ' ' MET . 1.5 tmt? -66.04 -38.83 89.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.869 174.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 7.6 tt -55.38 -50.8 68.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.895 0.379 . . . . 0.0 110.405 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 13.1 m -67.62 -34.64 77.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.486 0.66 . . . . 0.0 110.808 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -74.36 -37.49 63.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.097 -176.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -66.26 -32.04 73.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.649 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' 1030 ' ' VAL . 12.0 t-80 -66.67 -32.49 73.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.4 -50.97 57.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.923 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.082 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -67.4 -30.7 70.53 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.261 0.553 . . . . 0.0 110.304 -178.168 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.647 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.52 -41.41 76.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.853 170.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' 1026 ' ' HIS . 88.8 t -66.67 -31.12 52.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.649 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.703 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 5.8 m-20 -59.07 -47.48 85.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.046 0.45 . . . . 0.0 109.961 176.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.12 87.19 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.567 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.759 ' O ' ' HG ' ' A' 1036 ' ' LEU . 31.0 mmmt -63.31 -36.63 84.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.123 0.487 . . . . 0.0 111.358 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' 1038 ' ' VAL . 2.3 t30 -68.71 -39.67 80.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.381 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 991' ' ' LEU . 12.1 tp -78.86 -22.23 46.35 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.866 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.778 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -67.95 -31.59 71.44 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' 1041 ' ' GLN . 28.3 t70 -75.89 -31.89 59.41 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.512 171.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.056 HG13 ' HB3' ' A' ' 983' ' ' GLU . 33.9 t -64.04 -67.31 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.297 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.749 HG12 ' O ' ' A' 1035 ' ' LEU . 7.7 pt -80.99 -32.23 12.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.061 -170.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.573 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 12.6 t0 -55.11 -45.93 75.52 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 166.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.65 ' HB2' ' O ' ' A' 1037 ' ' ASP . 2.7 mp0 -67.86 -28.65 67.72 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.147 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.63 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -52.81 -53.18 52.13 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-O 120.861 0.362 . . . . 0.0 111.063 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.453 ' HB3' ' HG3' ' A' ' 920' ' ' ARG . 0.9 OUTLIER -54.21 -36.6 63.64 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.008 176.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.871 ' HB2' ' HD3' ' A' ' 920' ' ' ARG . 14.6 tp -76.81 -25.25 53.07 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.982 -0.449 . . . . 0.0 111.539 173.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.779 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 25.0 mmtp -63.21 -21.39 66.19 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 172.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' 1043 ' ' ARG . 11.9 tmm? -74.89 -43.91 51.77 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.728 -1.123 . . . . 0.0 108.913 176.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.499 ' HB ' HD12 ' A' 1044 ' ' LEU . 3.9 mp -61.31 -41.57 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 121.609 0.719 . . . . 0.0 109.868 170.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.519 ' HB2' ' HA ' ' A' 1045 ' ' LYS . 32.8 m -69.35 -12.73 61.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.093 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.391 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.564 ' HG3' ' HB3' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 120.964 0.411 . . . . 0.0 110.17 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 17.7 p -91.31 25.38 2.58 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.551 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.559 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.28 54.71 7.02 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.218 -175.553 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.48 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -47.01 -173.27 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 125.763 1.914 . . . . 0.0 112.084 -176.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.597 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.0 tmtm? -39.01 -22.74 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.385 0.674 . . . . 0.0 111.685 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 1.022 ' HA ' HG23 ' A' ' 968' ' ' THR . 14.8 m -56.64 -52.82 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.599 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.437 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 12.9 t80 -77.91 -32.99 52.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 930' ' ' THR . 3.3 tt0 -61.19 -58.57 7.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 113.208 -1.815 . . . . 0.0 112.102 -174.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -71.99 -32.27 67.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.59 -172.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.619 ' HA ' HD12 ' A' ' 965' ' ' LEU . 39.9 t -63.33 -35.09 70.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.092 173.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.533 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -65.33 -39.05 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 169.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.07 -29.75 62.85 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.935 175.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.82 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 22.5 tp -65.39 -38.79 91.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.479 ' HA ' HG12 ' A' ' 936' ' ' VAL . 38.2 t -67.66 -40.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.13 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -61.8 -30.6 70.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.159 0.504 . . . . 0.0 110.107 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.6 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -76.65 -26.33 54.72 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.354 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.0 p -85.04 -4.97 9.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.899 0.857 . . . . 0.0 109.092 172.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 62.4 mt -81.46 -38.63 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 163.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 73.0 mm-40 -52.77 -40.28 63.0 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.364 167.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.705 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.26 -44.93 92.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.839 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.619 ' O ' HG22 ' A' ' 943' ' ' ILE . 5.0 p -74.57 -27.36 60.46 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.4 p -79.13 -44.98 20.93 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.694 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 0.1 OUTLIER -51.35 -43.53 61.83 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 113.304 -1.771 . . . . 0.0 110.889 172.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 940' ' ' SER . 0.3 OUTLIER -67.54 -29.37 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 O-C-N 123.841 0.713 . . . . 0.0 110.746 -175.498 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.821 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.8 mm-40 -52.01 -58.58 10.81 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-O 119.398 -0.334 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.821 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 56.6 Cg_endo -101.25 26.22 0.13 Allowed 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 121.884 1.723 . . . . 0.0 113.166 175.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.694 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -83.86 121.87 76.1 Favored Pre-proline 0 C--N 1.33 -0.249 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -174.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.768 ' HD2' ' HG3' ' A' ' 950' ' ' GLU . 92.7 Cg_endo -82.04 -176.2 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.814 2.343 . . . . 0.0 109.568 156.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.958 ' HA ' ' HD2' ' A' ' 951' ' ' TYR . 8.9 Cg_endo -51.71 -41.15 63.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.456 2.104 . . . . 0.0 112.743 177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -64.69 -7.41 10.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.021 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.768 ' HG3' ' HD2' ' A' ' 947' ' ' PRO . 5.9 mm-40 -109.46 -17.09 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.261 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.958 ' HD2' ' HA ' ' A' ' 948' ' ' PRO . 31.8 m-85 -59.42 -37.3 77.7 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.058 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.41 -50.41 2.77 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.621 177.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.058 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.1 Cg_exo -56.31 -36.74 97.36 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.727 2.284 . . . . 0.0 114.854 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.705 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.6 ptp -60.14 -47.52 85.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.747 0.784 . . . . 0.0 108.973 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' 1002 ' ' MET . 61.8 t -65.22 -28.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.334 172.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.0 tptm -62.06 -37.34 84.63 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.484 ' HG3' ' HB3' ' A' ' 938' ' ' GLU . 71.1 mm-40 -55.74 -47.14 77.44 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.608 174.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 1.004 HG21 HD23 ' A' ' 998' ' ' LEU . 3.6 m -72.47 -28.88 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.791 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.579 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.39 -44.92 32.12 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.063 -1.065 . . . . 0.0 111.783 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.65 -31.72 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.82 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.41 -55.23 36.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.531 178.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.675 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 4.6 tt -65.34 -32.77 74.58 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.327 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.485 ' HA ' ' HD3' ' A' ' 963' ' ' ARG . 30.8 mmt180 -65.02 -48.64 73.19 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 122.009 -0.432 . . . . 0.0 111.583 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.451 HG22 ' OD1' ' A' ' 928' ' ' ASN . 11.1 m -60.04 -37.46 79.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.358 0.599 . . . . 0.0 109.937 172.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 3.2 tt -59.03 -30.43 68.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.49 173.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.523 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 52.5 tp -66.6 -31.44 72.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 970' ' ' ASP . . . -65.65 -41.45 92.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.942 0.877 . . . . 0.0 109.658 173.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 1.022 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -60.96 -38.6 86.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.742 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 70.7 t -55.4 -30.79 26.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.001 171.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.656 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.7 t70 -65.45 -29.59 70.28 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 122.406 -0.184 . . . . 0.0 111.313 177.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.614 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 54.2 mm-40 -65.95 -52.11 52.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 122.293 1.044 . . . . 0.0 109.658 172.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.531 ' HB3' ' CG1' ' A' 1039 ' ' ILE . 60.7 p -66.35 -23.3 66.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.153 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.857 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 65.1 tp -58.66 -54.72 53.39 Favored Pre-proline 0 C--O 1.217 -0.606 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.656 ' HD3' ' O ' ' A' ' 970' ' ' ASP . 26.1 Cg_exo -64.86 -25.55 60.18 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.397 1.535 . . . . 0.0 110.319 172.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 971' ' ' GLU . 5.3 t -75.6 -16.37 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 119.909 -0.717 . . . . 0.0 111.5 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.857 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 4.6 pp -80.45 -38.48 1.09 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 118.344 -0.836 . . . . 0.0 113.001 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.734 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 21.9 Cg_exo -66.34 -26.63 48.28 Favored 'Trans proline' 0 C--N 1.36 1.132 0 CA-C-N 121.578 1.599 . . . . 0.0 110.0 171.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' 1049 ' ' GLN . . . -69.84 -51.82 30.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.266 173.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.8 m -162.57 -48.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.962 HG22 ' HB ' ' A' ' 984' ' ' ILE . 51.4 m -46.92 -20.45 0.14 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.653 ' HB2' ' O ' ' A' ' 976' ' ' LEU . 19.5 t-80 -51.72 -20.15 1.97 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -76.81 -54.45 6.6 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.941 -177.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.077 ' HB2' HG22 ' A' 1038 ' ' VAL . 7.9 pm0 -78.64 -37.39 42.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 121.813 -0.554 . . . . 0.0 111.839 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.962 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.8 tp -62.03 -21.88 27.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.45 -47.13 51.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.059 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.487 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 22.7 ptp -72.26 -46.26 56.63 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.768 -170.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.65 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.73 -45.55 20.95 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -175.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.98 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.9 tt0 -62.21 -43.68 98.29 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.178 -175.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.445 ' NZ ' ' HB3' ' A' ' 989' ' ' LYS . 9.8 mtpm? -66.63 -32.61 74.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.415 0.626 . . . . 0.0 109.474 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.861 HD23 HD22 ' A' 1034 ' ' ASN . 3.3 tp -65.13 -43.72 91.01 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.378 177.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.05 HD23 ' HB3' ' A' 1031 ' ' ASP . 22.8 mt -60.0 -45.98 90.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.01 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.94 -41.55 71.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.654 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.1 m -73.04 -34.37 66.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.256 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.686 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -103.97 -31.67 9.62 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -170.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.857 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -57.93 -38.46 75.96 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 165.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -55.57 -48.98 73.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.685 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -65.75 -32.31 73.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.718 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 1.004 HD23 HG21 ' A' ' 958' ' ' VAL . 14.1 tp -71.34 -26.78 62.97 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 119.11 -1.036 . . . . 0.0 108.898 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HG2' ' A' 1002 ' ' MET . 64.4 mt -62.36 -27.14 42.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.375 0.607 . . . . 0.0 109.605 169.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 77.5 m-20 -80.68 -6.71 58.77 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.665 ' HA ' ' HG3' ' A' 1021 ' ' MET . 58.2 tttm -80.07 -45.24 18.62 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 172.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.893 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 17.7 ptp -64.34 -38.0 89.47 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 175.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.822 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.6 tttp -67.87 -61.94 1.64 Allowed 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.712 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.648 ' HB2' ' O ' ' A' 1000 ' ' ASN . 4.8 tp -56.49 -56.08 25.72 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -173.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.6 -46.62 83.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.16 0.505 . . . . 0.0 110.785 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -24.14 54.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.952 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.822 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.0 OUTLIER -69.07 -46.08 68.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.825 -173.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.63 ' HB2' ' CE2' ' A' 1017 ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.426 0 C-N-CA 119.989 -0.684 . . . . 0.0 111.256 175.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.702 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.408 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -52.82 -38.27 61.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -165.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -47.19 -51.56 18.15 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.079 0.466 . . . . 0.0 111.684 171.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.641 ' HA ' HD23 ' A' 1004 ' ' LEU . 3.2 m-85 -68.33 -23.87 64.76 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.968 0.889 . . . . 0.0 109.204 -173.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.702 ' HB2' HE22 ' A' 1014 ' ' GLN . 85.3 tttt -79.41 -41.66 27.17 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.05 176.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 79.0 tttt -77.96 -33.76 51.38 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.59 0.71 . . . . 0.0 111.643 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.01 -45.74 14.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.276 -0.874 . . . . 0.0 108.9 -171.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.665 ' HG3' ' HA ' ' A' 1001 ' ' LYS . 25.8 mmt -75.37 -17.74 60.14 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.824 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1018 ' ' LYS . 58.8 tp -63.45 -43.53 97.13 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 171.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.3 m -61.62 -28.65 69.52 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.3 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.82 -30.92 51.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.742 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -67.45 -40.61 85.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.327 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.534 ' O ' HG23 ' A' 1030 ' ' VAL . 14.8 t-80 -58.39 -38.02 76.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.103 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.0 -49.54 69.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.857 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -68.3 -29.05 67.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.34 0.59 . . . . 0.0 110.07 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.498 ' N ' HD23 ' A' 1028 ' ' LEU . . . -59.75 -42.68 93.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.604 172.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' 1026 ' ' HIS . 47.7 t -67.03 -31.4 53.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.957 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 1.05 ' HB3' HD23 ' A' ' 991' ' ' LEU . 2.4 m-20 -56.19 -46.93 79.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.665 173.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.79 -53.53 57.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.313 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -54.1 -42.0 68.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.905 0.384 . . . . 0.0 111.646 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.861 HD22 HD23 ' A' ' 990' ' ' LEU . 50.6 t30 -63.72 -49.83 71.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.823 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.915 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -73.13 -27.57 61.75 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.468 ' N ' HG11 ' A' ' 929' ' ' VAL . 4.4 tt -57.5 -35.86 70.77 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.527 0.731 . . . . 0.0 110.737 177.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -92.51 -33.68 14.37 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.077 HG22 ' HB2' ' A' ' 983' ' ' GLU . 2.0 t -56.09 -46.57 80.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.367 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.2 tt -93.48 -28.51 4.38 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.938 -172.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 7.5 t70 -57.33 -42.81 82.61 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 161.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 15.2 mm100 -69.81 -31.44 69.35 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.707 174.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.588 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.82 -56.11 20.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.05 0.452 . . . . 0.0 110.553 171.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.2 tpt180 -57.29 -33.86 68.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.618 177.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.462 HD13 HH11 ' A' ' 920' ' ' ARG . 63.3 tp -69.01 -41.82 77.25 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 121.094 -0.243 . . . . 0.0 111.066 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.891 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 42.1 mmtm -51.09 -37.39 45.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.029 0.919 . . . . 0.0 110.079 174.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.435 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 28.0 ttt -68.82 -38.06 79.61 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.271 -1.331 . . . . 0.0 110.017 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' 1043 ' ' ARG . 42.8 mm -67.56 -36.3 75.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.38 173.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' 1045 ' ' LYS . 71.0 m -56.15 -51.39 68.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.305 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . 0.664 ' HG3' ' HB1' ' A' ' 978' ' ' ALA . 15.8 mm100 . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.219 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.73 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.624 0.25 . . . . 0.0 110.791 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 28.4 t -68.89 139.09 55.13 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 166.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.657 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER -72.02 67.91 0.66 Allowed 'General case' 0 CA--C 1.499 -1.002 0 C-N-CA 122.538 0.335 . . . . 0.0 111.524 -173.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 925' ' ' VAL . 8.2 t70 -47.87 -173.92 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 O-C-N 125.902 2.001 . . . . 0.0 112.325 -173.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 5.1 tmtp? -39.27 -19.76 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 124.042 0.937 . . . . 0.0 112.508 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.959 ' HA ' HG23 ' A' ' 968' ' ' THR . 3.7 m -62.01 -57.16 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 123.037 0.535 . . . . 0.0 112.193 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 23.3 t80 -78.97 -31.28 44.87 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 122.206 1.003 . . . . 0.0 108.764 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 7.8 mm-40 -60.84 -59.49 5.3 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.953 -1.476 . . . . 0.0 112.188 -175.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 5.1 t30 -73.65 -32.54 64.05 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.671 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.7 p -62.63 -37.11 78.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 119.904 -0.719 . . . . 0.0 110.423 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.529 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 31.0 m -66.65 -33.94 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.291 0.567 . . . . 0.0 109.586 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.27 -31.07 65.29 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.381 173.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.718 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 25.9 tp -62.99 -41.78 99.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.004 0.43 . . . . 0.0 109.886 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 937' ' ' ILE . 48.2 t -62.3 -43.02 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 0.0 110.011 174.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -55.95 -40.89 73.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.724 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.36 -31.63 62.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.864 -177.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.627 ' HA ' HG22 ' A' ' 958' ' ' VAL . 13.0 p -77.41 -16.8 14.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.441 174.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.5 mm -72.55 -42.46 63.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 165.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 45.1 mt-10 -54.44 -37.2 64.87 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.937 172.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.553 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 42.9 ttp -57.94 -45.86 85.94 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.626 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.5 t -72.48 -32.84 66.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.857 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 24.0 m -77.64 -47.01 20.33 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.999 0.905 . . . . 0.0 109.968 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.563 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -78.86 -15.94 57.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.477 -174.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.855 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 6.8 tt -78.99 -25.62 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.106 172.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.699 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.2 mm-40 -50.93 -53.72 44.81 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.1 Cg_endo -104.43 36.26 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.09 1.86 . . . . 0.0 114.319 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.726 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -138.16 155.53 74.26 Favored Pre-proline 0 N--CA 1.466 0.33 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.528 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 50.5 Cg_endo -90.47 -176.72 1.1 Allowed 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 124.043 3.162 . . . . 0.0 112.091 176.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.765 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.8 Cg_exo -51.96 -31.77 44.99 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.976 2.451 . . . . 0.0 113.086 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.421 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 47.1 mt-10 -53.99 -36.17 62.63 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.557 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.726 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.4 mp0 -98.65 0.09 44.03 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.765 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 15.8 m-30 -61.27 -41.21 96.55 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.0 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -75.02 -51.25 3.64 Favored Pre-proline 0 CA--C 1.557 1.212 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.729 176.05 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.991 ' HD3' HG13 ' A' ' 952' ' ' VAL . 79.9 Cg_exo -51.54 -33.74 49.19 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.408 2.072 . . . . 0.0 115.112 173.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.855 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 27.3 ptt? -67.48 -45.84 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.182 0.515 . . . . 0.0 109.997 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.691 HG13 ' HG ' ' A' ' 998' ' ' LEU . 87.2 t -64.67 -27.14 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.502 173.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.7 ttpm? -59.4 -37.02 76.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -54.69 -46.09 74.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.882 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.627 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.1 t -69.95 -36.23 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.851 176.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.639 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.02 -44.46 67.16 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.358 -0.925 . . . . 0.0 112.872 -176.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.21 -32.34 72.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.884 0.374 . . . . 0.0 110.486 171.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.19 -55.92 21.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.616 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 1.8 tm? -63.8 -35.03 79.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.527 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -57.42 -57.38 12.93 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 121.827 -0.546 . . . . 0.0 111.114 171.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -55.81 -31.07 62.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.367 0.603 . . . . 0.0 110.65 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' 1035 ' ' LEU . 2.5 tm? -65.56 -39.87 92.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.057 176.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.5 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 8.6 tt -54.75 -33.53 61.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.043 176.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.25 79.27 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 110.317 174.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.959 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.4 m -56.03 -40.75 73.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.837 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.667 HG13 HD11 ' A' ' 984' ' ' ILE . 79.1 t -54.2 -32.0 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.681 173.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.779 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 24.9 t70 -68.06 -32.37 72.66 Favored 'General case' 0 C--O 1.219 -0.506 0 O-C-N 122.472 -0.143 . . . . 0.0 111.01 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.63 -53.0 63.13 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.78 1.276 . . . . 0.0 108.575 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.577 ' OG ' HG21 ' A' ' 980' ' ' THR . 26.7 t -65.42 -22.35 66.76 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.106 -1.406 . . . . 0.0 112.176 178.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.643 ' O ' ' HD3' ' A' ' 977' ' ' PRO . 6.4 tt -59.73 -54.96 50.57 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.916 -177.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.779 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.8 Cg_endo -58.84 -22.42 62.18 Favored 'Trans proline' 0 C--N 1.357 1.007 0 CA-C-N 121.58 1.6 . . . . 0.0 111.133 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.587 HG12 ' HB ' ' A' ' 980' ' ' THR . 60.0 t -74.35 -16.44 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.038 173.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 1.002 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -75.19 -41.37 3.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.42 -0.8 . . . . 0.0 112.409 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 1.002 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 23.7 Cg_exo -65.69 -27.07 52.91 Favored 'Trans proline' 0 C--N 1.361 1.219 0 CA-C-N 120.957 1.378 . . . . 0.0 110.354 171.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.06 -60.49 2.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.775 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.565 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 37.4 m -166.56 -34.2 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.817 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 1.5 t -63.38 -15.71 58.31 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -167.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.676 ' HA ' HG22 ' A' ' 984' ' ' ILE . 81.3 t60 -49.38 -21.03 0.78 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -71.29 -53.59 13.74 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.019 -0.673 . . . . 0.0 110.732 176.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.095 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -76.75 -42.69 40.1 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.676 HG22 ' HA ' ' A' ' 981' ' ' HIS . 11.3 tp -59.38 -28.54 39.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.892 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -73.53 -40.95 63.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.533 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.4 ptp -64.87 -57.48 8.72 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.055 -172.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.16 -42.04 27.08 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -174.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.974 ' HA ' HD12 ' A' ' 991' ' ' LEU . 41.6 tt0 -57.35 -42.91 82.92 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.213 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -68.62 -31.02 69.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.366 0.603 . . . . 0.0 109.512 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.793 ' HG ' ' CG ' ' A' 1031 ' ' ASP . 3.1 tp -75.42 -31.81 60.5 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.673 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.974 HD12 ' HA ' ' A' ' 988' ' ' GLN . 44.1 mt -64.71 -49.79 69.49 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.229 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -58.24 -40.39 81.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.535 -177.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 20.2 m -76.98 -35.33 57.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.465 -176.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.96 -31.48 12.15 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.052 ' HA ' HD22 ' A' 1028 ' ' LEU . 1.8 tm? -56.43 -37.64 70.5 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 162.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.564 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -60.42 -48.01 83.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.89 176.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.479 ' O ' ' HD3' ' A' 1001 ' ' LYS . 18.5 mt-10 -59.47 -37.09 77.31 Favored 'General case' 0 CA--C 1.504 -0.797 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.712 176.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.691 ' HG ' HG13 ' A' ' 955' ' ' VAL . 24.2 tp -68.63 -33.42 73.98 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.658 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.594 ' O ' ' HG2' ' A' 1002 ' ' MET . 33.8 pt -79.26 -25.24 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.911 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.516 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.4 m-80 -79.73 -17.06 54.43 Favored 'General case' 0 C--O 1.211 -0.968 0 O-C-N 122.219 -0.3 . . . . 0.0 110.349 167.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.69 ' CG ' ' HA ' ' A' 1021 ' ' MET . 0.3 OUTLIER -86.49 -31.71 21.17 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.619 178.342 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.0 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -69.18 -36.28 77.17 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 167.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.776 ' O ' ' HB2' ' A' 1007 ' ' GLN . 59.9 tttp -62.44 -56.14 20.99 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.921 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' 1000 ' ' ASN . 29.1 mt -58.88 -43.86 91.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.33 -46.78 85.56 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.134 0.492 . . . . 0.0 110.23 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.24 -19.2 56.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.16 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.776 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -76.21 -44.82 36.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.453 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.702 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.588 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -54.98 -43.76 73.81 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.2 tt0 -50.27 -43.82 53.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.443 174.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.422 ' CE2' HD22 ' A' 1004 ' ' LEU . 2.1 m-30 -77.97 -23.4 48.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.547 0.213 . . . . 0.0 110.681 -179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.588 ' HB2' HE22 ' A' 1014 ' ' GLN . 39.3 ttpt -65.76 -37.0 85.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -71.29 -48.97 47.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.2 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' 1016 ' ' GLU . 70.7 mm-40 -52.13 -37.45 54.37 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 110.564 172.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.69 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 51.8 ttp -63.52 -50.21 70.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.75 176.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' 1018 ' ' LYS . 98.0 mt -61.9 -28.78 69.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.866 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 37.8 m -66.44 -36.73 83.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.489 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.57 -40.03 35.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.577 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.7 80.05 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.237 176.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' 1030 ' ' VAL . 13.9 t60 -54.79 -51.59 65.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.441 176.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.632 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.052 HD22 ' HA ' ' A' ' 995' ' ' LEU . 12.3 tp -73.39 -42.6 61.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.218 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.25 84.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' 1026 ' ' HIS . 54.7 t -67.03 -42.02 88.01 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.335 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.793 ' CG ' ' HG ' ' A' ' 990' ' ' LEU . 25.4 t0 -66.04 -32.29 73.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 176.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.12 -44.97 71.78 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 167.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.688 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 41.6 mtpt -70.84 -23.08 62.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.932 174.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.558 ' O ' HG23 ' A' 1038 ' ' VAL . 48.9 t30 -74.0 -43.79 56.8 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tp -79.85 -21.51 44.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.136 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.828 ' HA ' HG11 ' A' ' 929' ' ' VAL . 2.7 pp -72.08 -22.03 61.42 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.3 t70 -81.15 -48.08 12.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.506 168.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.095 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.4 t -47.89 -61.69 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.444 176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.712 HG12 ' HB ' ' A' ' 925' ' ' VAL . 8.7 tt -89.75 -25.47 5.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 CA-C-N 114.351 -1.295 . . . . 0.0 112.061 -167.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.855 ' O ' ' HG3' ' A' 1043 ' ' ARG . 18.5 t70 -63.34 -33.36 75.35 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 118.983 -1.087 . . . . 0.0 109.032 162.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' 1037 ' ' ASP . 60.6 mt-30 -76.61 -26.86 55.42 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 118.735 -1.186 . . . . 0.0 109.149 171.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.659 ' HA ' ' HB2' ' A' 1045 ' ' LYS . . . -55.01 -50.31 69.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 117.913 0.324 . . . . 0.0 110.581 171.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.855 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -53.39 -41.33 65.81 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.815 178.671 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.622 ' N ' ' HD2' ' A' 1043 ' ' ARG . 31.8 tp -79.85 -29.82 40.17 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 122.006 -0.434 . . . . 0.0 111.395 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.817 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 7.6 mptt -55.05 -46.39 75.35 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.811 0.844 . . . . 0.0 110.173 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 24.8 ttt -62.23 -45.01 95.26 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.715 178.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.467 ' CD1' ' HB2' ' A' ' 920' ' ' ARG . 1.7 mp -67.99 -21.48 26.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.573 176.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' 1045 ' ' LYS . 32.5 t -66.63 -36.85 83.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 0.0 110.422 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.225 179.839 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 1.134 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 120.729 0.3 . . . . 0.0 111.675 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.0 t -113.18 31.54 6.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.175 -175.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.472 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER 51.16 56.38 8.06 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.125 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.3 m-20 -47.26 -173.17 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.101 2.125 . . . . 0.0 112.932 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.8 tmtm? -40.27 -17.38 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.453 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.727 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -63.63 -53.23 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.767 174.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -77.55 -29.92 52.46 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 46.5 mt-10 -61.07 -60.73 3.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.278 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.48 HD21 HG22 ' A' ' 964' ' ' THR . 10.4 t-20 -67.91 -41.74 82.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.247 -171.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.911 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.1 p -60.09 -37.8 74.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.255 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.423 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 28.1 m -68.59 -31.17 70.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.099 0.476 . . . . 0.0 110.069 173.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.56 -32.21 68.54 Favored Glycine 0 CA--C 1.521 0.463 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.149 172.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.988 HD12 ' HB2' ' A' 1032 ' ' ALA . 3.4 tm? -61.54 -45.48 93.98 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.3 t -58.86 -42.71 86.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.209 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.512 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.0 mmtp -67.14 -21.61 65.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.365 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.16 -31.61 44.05 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.757 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.98 -13.91 11.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 119.679 -0.809 . . . . 0.0 109.04 172.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 933' ' ' VAL . 45.9 mm -68.21 -43.04 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 164.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 6.4 mm-40 -54.05 -45.17 71.58 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.298 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.805 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.0 tmt? -57.59 -42.18 82.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.251 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 24.2 m -69.04 -30.51 68.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.104 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.599 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 16.7 m -78.33 -43.14 28.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.3 mmtp -56.16 -42.08 76.46 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 113.335 -1.757 . . . . 0.0 111.759 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.747 HD11 ' HE2' ' A' 1018 ' ' LYS . 13.9 tt -73.82 -23.26 18.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.05 -177.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 34.4 mm-40 -53.67 -62.75 3.26 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.2 Cg_endo -99.95 -4.0 0.61 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.545 1.496 . . . . 0.0 114.515 -175.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.638 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -114.15 150.19 43.22 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -170.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 3.4 Cg_exo -82.84 -178.56 3.95 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.223 3.282 . . . . 0.0 112.961 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.725 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 85.7 Cg_exo -50.03 -33.16 33.65 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 123.624 2.883 . . . . 0.0 114.269 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.62 -29.74 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.493 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.638 ' HG3' ' HB1' ' A' ' 946' ' ' ALA . 63.9 mm-40 -97.45 -4.95 37.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.108 177.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.725 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -56.34 -40.79 75.03 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 172.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.03 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.5 OUTLIER -77.13 -48.57 2.51 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.786 176.162 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.2 Cg_exo -52.56 -27.62 33.39 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 121.702 1.601 . . . . 0.0 114.6 172.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.805 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 19.9 ptp -74.2 -34.86 63.86 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.435 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -65.98 -26.76 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.745 171.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.717 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.2 tttm -53.24 -44.18 67.91 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 173.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.451 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 2.9 mm-40 -55.49 -47.67 75.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.818 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.477 HG21 HD23 ' A' ' 998' ' ' LEU . 5.0 m -75.31 -30.77 23.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.33 -45.29 31.01 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.873 -174.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.65 -27.3 68.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.81 0.338 . . . . 0.0 110.341 172.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.59 -52.78 62.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.673 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.6 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 2.8 tm? -66.53 -31.24 71.84 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.559 0.618 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.556 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 50.6 ttm-85 -64.61 -48.07 76.27 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 121.784 -0.572 . . . . 0.0 111.074 173.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.48 HG22 HD21 ' A' ' 928' ' ' ASN . 39.7 m -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.262 0.553 . . . . 0.0 110.11 171.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.552 HD11 ' HA ' ' A' ' 929' ' ' VAL . 0.5 OUTLIER -61.3 -39.42 90.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.668 176.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 52.4 tp -52.21 -32.9 38.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.646 174.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.72 98.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.435 0.636 . . . . 0.0 109.783 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.727 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.7 m -62.38 -38.66 90.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.241 172.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.683 HG13 HD11 ' A' ' 984' ' ' ILE . 93.6 t -54.05 -29.57 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.028 173.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 17.7 t70 -75.92 -25.59 56.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.798 -0.183 . . . . 0.0 111.041 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -66.92 -51.97 48.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.39 1.09 . . . . 0.0 109.163 171.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.407 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 33.3 p -63.7 -22.48 66.93 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.918 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.586 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 22.1 tp -54.45 -57.21 19.72 Favored Pre-proline 0 CA--C 1.54 0.579 0 CA-C-O 118.697 -0.668 . . . . 0.0 112.221 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 20.4 Cg_endo -64.16 -20.64 67.42 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.136 1.442 . . . . 0.0 111.167 173.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 1042 ' ' ALA . 54.5 t -75.17 -18.81 16.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.116 175.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.736 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.9 pp -74.89 -44.36 4.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.882 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.736 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 21.7 Cg_endo -64.3 -26.95 63.71 Favored 'Trans proline' 0 C--N 1.364 1.353 0 CA-C-N 121.145 1.445 . . . . 0.0 110.64 172.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.37 -59.84 3.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.593 172.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.596 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 75.2 m -160.82 -49.01 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.716 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 2.0 t -56.59 -14.35 3.11 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -166.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.603 ' HA ' HG22 ' A' ' 984' ' ' ILE . 20.8 p-80 -51.26 -22.88 3.01 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -170.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.49 ' HA ' ' NE ' ' A' ' 982' ' ' ARG . 4.1 tpm_? -78.69 -51.18 10.19 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 110.026 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.867 ' HG3' HG22 ' A' 1038 ' ' VAL . 2.7 tp10 -73.34 -42.77 61.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.964 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.683 HD11 HG13 ' A' ' 969' ' ' VAL . 0.1 OUTLIER -55.79 -40.18 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -173.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -73.37 -31.18 63.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.792 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptp -63.89 -49.13 73.93 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.876 -178.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.18 -39.12 34.17 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 116.876 -0.147 . . . . 0.0 111.174 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 1.094 ' HA ' HD12 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -58.11 -47.6 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.799 -178.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -60.83 -35.83 77.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.543 0.687 . . . . 0.0 109.47 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.449 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.4 OUTLIER -68.25 -45.0 74.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.757 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.094 HD12 ' HA ' ' A' ' 988' ' ' GLN . 3.8 mt -58.76 -55.8 30.39 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.546 0.689 . . . . 0.0 110.507 -177.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -59.93 -33.1 71.45 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.821 -171.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 12.2 p -74.55 -38.49 62.72 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.679 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 51.3 m-20 -103.17 -28.63 11.81 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.087 -172.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.9 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.56 -42.83 93.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.217 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.613 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -64.15 -44.35 92.39 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.926 175.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.626 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 38.2 tt0 -53.41 -46.55 69.79 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.492 176.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' 1002 ' ' MET . 28.2 tp -67.08 -38.55 85.95 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.898 -173.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.752 ' HA ' HG21 ' A' ' 955' ' ' VAL . 32.1 pt -61.05 -31.56 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.541 -178.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.624 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -95.32 -12.48 26.04 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.195 178.358 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.626 ' HG3' ' HG2' ' A' ' 997' ' ' GLU . 4.7 mmmm -84.74 -33.88 22.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.799 0.333 . . . . 0.0 110.453 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.698 ' SD ' ' HG3' ' A' 1021 ' ' MET . 72.7 mmm -74.4 -44.54 51.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 174.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 47.1 tttp -53.47 -44.27 68.83 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.872 167.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.717 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 18.1 tp -58.71 -49.02 79.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 175.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.687 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -59.12 -40.28 84.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.561 0.696 . . . . 0.0 109.671 175.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.616 ' HG3' HG12 ' A' ' 952' ' ' VAL . 1.1 tm0? -64.49 -33.3 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.733 173.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.31 -24.36 50.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.123 -174.188 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.694 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.4 t80 . . . . . 0 C--N 1.32 -0.703 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.603 174.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 C--O 1.224 -0.278 0 CA-C-O 121.51 0.672 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' 1018 ' ' LYS . 12.1 tp60 -61.01 -38.47 86.2 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.528 -173.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -58.53 -36.15 73.42 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.401 -0.52 . . . . 0.0 111.406 171.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 0.7 OUTLIER -70.22 -23.36 62.92 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.416 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.747 ' HE2' HD11 ' A' ' 943' ' ' ILE . 64.6 tttm -80.33 -25.05 39.49 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.564 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -74.71 -54.14 7.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -53.1 -32.15 45.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.657 170.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.698 ' HG3' ' SD ' ' A' 1002 ' ' MET . 33.1 ttp -57.02 -49.0 77.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.591 175.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -64.02 -49.92 70.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -60.08 -37.57 80.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.147 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -73.78 -40.07 63.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.478 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.28 -34.85 79.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.614 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.56 ' O ' HG23 ' A' 1030 ' ' VAL . 76.4 t60 -74.28 -38.6 63.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.52 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.62 83.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 173.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.9 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -56.56 -46.04 80.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.007 176.233 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' 1033 ' ' LYS . . . -55.67 -30.85 61.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.478 176.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 1026 ' ' HIS . 57.7 t -71.94 -33.0 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.679 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 1.1 m-20 -51.77 -47.71 64.05 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.505 0.669 . . . . 0.0 109.3 172.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.988 ' HB2' HD12 ' A' ' 932' ' ' LEU . . . -66.46 -48.55 69.55 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.76 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.601 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 89.1 mttt -60.6 -39.67 88.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.716 -174.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' 1038 ' ' VAL . 65.5 t30 -71.26 -36.95 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.034 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.773 HD22 HD11 ' A' ' 991' ' ' LEU . 20.4 tp -77.84 -29.4 50.5 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.544 -177.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.911 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -68.35 -24.86 64.86 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' 1041 ' ' GLN . 38.6 t70 -81.8 -45.47 15.54 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.864 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.867 HG22 ' HG3' ' A' ' 983' ' ' GLU . 24.5 t -53.89 -62.16 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.806 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.77 HG12 ' O ' ' A' 1035 ' ' LEU . 8.2 pt -84.0 -27.46 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -173.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.612 ' O ' ' HG3' ' A' 1043 ' ' ARG . 26.5 t70 -61.06 -30.8 70.54 Favored 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 118.145 -1.422 . . . . 0.0 108.893 163.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.547 ' O ' ' HD3' ' A' 1045 ' ' LYS . 73.6 mt-30 -79.76 -24.04 41.81 Favored 'General case' 0 C--O 1.203 -1.394 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.677 169.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -58.22 -52.63 64.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.331 0.586 . . . . 0.0 109.822 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 1.134 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 6.5 ppt_? -57.3 -32.09 66.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.677 176.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' 1043 ' ' ARG . 51.7 tp -78.95 -29.68 44.16 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.177 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.716 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 12.0 mptt -61.52 -43.23 99.23 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.684 0.793 . . . . 0.0 110.167 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.1 ttt -64.33 -35.03 79.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.567 176.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' 1043 ' ' ARG . 45.6 mm -70.72 -43.54 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.914 174.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.5 m -51.74 -33.01 32.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.014 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . 0.418 ' HA ' ' OE1' ' A' 1049 ' ' GLN . 6.8 tp60 . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.682 0.277 . . . . 0.0 111.042 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 25.0 tpt180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 63.9 m 68.92 -1.71 1.97 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.563 0.697 . . . . 0.0 110.626 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.885 ' OD1' ' HA ' ' A' 1040 ' ' ASP . 0.4 OUTLIER 64.77 74.66 0.39 Allowed 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 114.364 -1.289 . . . . 0.0 113.952 174.436 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.558 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.1 t70 -48.88 -173.77 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 111.907 -2.406 . . . . 0.0 113.277 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.662 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.0 tmtp? -41.08 -14.52 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.617 1.167 . . . . 0.0 112.88 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.768 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.5 m -63.6 -51.58 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 C-N-CA 122.959 0.503 . . . . 0.0 112.042 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.772 ' HB2' ' OD1' ' A' ' 922' ' ' ASN . 49.0 t80 -75.49 -34.12 60.85 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.257 1.027 . . . . 0.0 108.384 -178.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.625 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 40.5 mt-10 -64.94 -58.7 5.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 113.475 -1.693 . . . . 0.0 112.59 -176.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.662 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 3.6 t-20 -73.36 -31.02 63.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -171.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.735 ' CG2' HD11 ' A' 1039 ' ' ILE . 22.7 t -68.28 -35.86 72.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.793 176.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.48 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 90.5 m -56.86 -25.31 56.29 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.553 0.692 . . . . 0.0 109.969 163.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . 0.477 ' HA2' ' HG2' ' A' ' 934' ' ' LYS . . . -71.84 -26.88 71.76 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.526 176.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.729 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.4 tt -61.93 -41.35 97.84 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 172.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.65 ' O ' HG12 ' A' ' 937' ' ' ILE . 45.0 t -61.06 -45.2 99.03 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.979 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.499 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.3 mmpt? -54.67 -44.49 73.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.551 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.708 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.01 -28.65 60.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.7 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.8 p -77.62 -18.38 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 119.869 -0.732 . . . . 0.0 109.629 174.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 933' ' ' VAL . 34.8 mm -67.95 -26.08 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 169.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 35.5 mm-40 -64.9 -42.47 94.74 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.322 173.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.724 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.6 ptt? -55.64 -42.14 74.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.331 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 9.7 p -75.07 -35.22 61.85 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 12.1 p -77.6 -48.95 15.63 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.264 0.554 . . . . 0.0 111.067 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.465 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -68.64 -22.19 64.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.386 -176.169 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.69 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 10.4 tp -79.89 -22.75 11.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.669 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.709 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 33.7 mm-40 -49.3 -54.97 24.44 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.826 -0.17 . . . . 0.0 110.96 175.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 76.2 Cg_endo -95.24 30.22 0.21 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.614 1.543 . . . . 0.0 113.2 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.934 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -133.11 153.26 80.76 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -173.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.631 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.9 Cg_endo -92.88 -175.23 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.025 3.15 . . . . 0.0 111.968 174.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.911 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 9.7 Cg_endo -53.17 -30.53 51.01 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.875 2.384 . . . . 0.0 112.836 176.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.404 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 32.2 mm-40 -57.66 -29.52 64.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.061 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.934 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 48.9 mm-40 -102.02 0.86 35.76 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.088 0.243 . . . . 0.0 111.198 175.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.911 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 1.7 m-85 -59.26 -44.03 92.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.023 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -74.78 -48.09 4.93 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.392 176.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.023 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.7 Cg_exo -55.77 -23.63 42.56 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 121.696 1.598 . . . . 0.0 114.596 172.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.751 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 22.2 ptt? -73.32 -36.44 66.23 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.114 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 1.035 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -66.63 -27.22 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.085 172.763 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 83.1 tttt -55.15 -42.1 72.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 175.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.86 -47.44 71.0 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.462 173.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.623 HG12 ' HA ' ' A' ' 936' ' ' VAL . 0.9 OUTLIER -68.47 -23.59 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.223 176.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.568 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -66.26 -42.69 94.01 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 963' ' ' ARG . 84.5 mt -70.27 -10.27 58.43 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.27 0.557 . . . . 0.0 110.362 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -78.83 -56.24 4.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.925 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.717 HD12 ' HB3' ' A' ' 991' ' ' LEU . 2.6 tt -66.67 -29.06 68.99 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.285 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.504 ' HD2' HD23 ' A' ' 960' ' ' LEU . 54.9 mtt-85 -59.56 -61.42 2.63 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.069 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 5.3 m -56.1 -30.66 62.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.059 0.457 . . . . 0.0 110.95 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.727 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -67.12 -41.43 86.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.912 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -52.91 -35.48 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.377 174.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -60.91 -49.4 77.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.142 0.496 . . . . 0.0 110.068 175.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.2 m -58.24 -42.86 87.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.775 171.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.716 HG13 HD11 ' A' ' 984' ' ' ILE . 53.3 t -54.42 -30.96 22.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.422 0.153 . . . . 0.0 111.168 174.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.632 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 19.3 t70 -71.62 -26.09 62.43 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 177.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 975' ' ' VAL . 39.1 mm-40 -69.09 -44.89 71.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.383 1.087 . . . . 0.0 108.889 169.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.604 ' OG ' HG21 ' A' ' 980' ' ' THR . 33.4 t -66.36 -24.56 66.52 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.857 178.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.704 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.5 OUTLIER -60.71 -52.98 68.73 Favored Pre-proline 0 C--O 1.214 -0.783 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.639 -177.264 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.632 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.5 Cg_endo -58.71 -26.82 81.29 Favored 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.676 1.634 . . . . 0.0 111.373 170.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.567 HG13 ' HB2' ' A' 1046 ' ' MET . 2.1 t -75.82 -15.9 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.527 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 1.039 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -64.53 -52.68 50.73 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.695 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.669 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 31.5 Cg_exo -62.71 -30.26 78.25 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 121.409 1.406 . . . . 0.0 111.084 175.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.27 -57.33 10.8 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.173 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.824 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 17.1 m -165.49 -36.36 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.242 0.544 . . . . 0.0 112.194 -174.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.792 HG22 ' HB ' ' A' ' 984' ' ' ILE . 70.7 m -56.18 -22.71 30.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -173.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 1.039 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 24.7 p-80 -51.05 -30.02 14.45 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.054 0.843 . . . . 0.0 112.808 -172.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 40.3 mtm105 -62.28 -55.39 28.7 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.927 -0.709 . . . . 0.0 111.532 173.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.758 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.47 -47.29 23.44 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.471 -0.491 . . . . 0.0 112.198 -174.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.792 ' HB ' HG22 ' A' ' 980' ' ' THR . 13.0 tt -55.27 -37.97 45.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.429 -172.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 2.9 pp20? -73.28 -31.7 64.22 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.181 -178.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.741 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 18.0 ptp -62.54 -56.76 14.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.218 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.707 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.11 -33.16 44.62 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.802 ' HA ' HD12 ' A' ' 991' ' ' LEU . 57.7 tt0 -60.43 -44.69 95.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.306 -178.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.565 ' HG3' ' O ' ' A' ' 985' ' ' GLU . 28.0 mtmm -64.73 -34.04 77.39 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.555 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 3.0 tp -64.12 -46.31 84.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.495 177.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.042 HD11 ' HG ' ' A' 1035 ' ' LEU . 13.2 mt -54.51 -60.14 3.76 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.075 0.464 . . . . 0.0 110.568 175.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -50.99 -43.03 60.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.241 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.558 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 42.0 t -62.35 -56.94 13.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.957 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.46 ' O ' HD23 ' A' ' 998' ' ' LEU . 1.8 m-20 -83.15 -42.89 16.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -168.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.925 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.8 OUTLIER -53.1 -55.1 26.55 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.701 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -54.75 -43.82 73.04 Favored 'General case' 0 N--CA 1.46 0.067 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 174.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.735 ' O ' ' HG2' ' A' 1001 ' ' LYS . 36.5 mt-10 -54.24 -43.29 70.77 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.241 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.719 ' O ' ' HG2' ' A' 1002 ' ' MET . 4.1 mm? -63.64 -36.47 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.049 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.88 ' HA ' HG11 ' A' ' 955' ' ' VAL . 11.1 pt -71.04 -7.87 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 119.99 -0.684 . . . . 0.0 109.972 -177.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 13.7 m-80 -113.13 -15.3 12.8 Favored 'General case' 0 C--O 1.207 -1.145 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.735 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 21.8 mmmt -73.75 -32.73 63.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.035 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 12.3 mmt -78.55 -42.02 30.46 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.7 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 16.1 tppt? -55.4 -45.18 76.66 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.206 169.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' 1004 ' ' LEU . 14.6 mt -61.51 -48.21 82.1 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.687 0.617 . . . . 0.0 112.286 175.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.78 -44.1 86.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.169 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.63 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.48 -16.56 59.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.841 178.12 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.684 ' HB2' ' O ' ' A' 1003 ' ' LYS . 7.6 tp-100 -81.42 -36.72 29.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.315 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.586 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.2 t80 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.332 178.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.531 0.23 0 CA-C-O 120.588 0.233 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.96 -31.6 65.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' 1020 ' ' GLN . 34.8 tt0 -54.46 -54.31 42.63 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.849 170.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.586 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-85 -60.21 -35.88 76.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.007 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -62.12 -36.34 81.48 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.597 0.237 . . . . 0.0 110.974 171.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' 1016 ' ' GLU . 14.5 tppt? -63.28 -54.9 30.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.041 0.448 . . . . 0.0 110.063 175.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' 1016 ' ' GLU . 6.8 mm-40 -51.3 -37.77 49.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.212 173.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -65.69 -41.8 91.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.122 177.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 69.8 mt -60.5 -44.25 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 111.408 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.8 m -66.04 -46.7 76.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.232 0.539 . . . . 0.0 110.229 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.639 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -62.28 -43.41 98.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.191 178.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.486 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -60.39 -31.57 70.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.775 0.321 . . . . 0.0 111.009 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' 1030 ' ' VAL . 12.2 t-80 -75.76 -35.69 60.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.575 -0.45 . . . . 0.0 109.847 176.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.39 94.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.925 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.8 tt -56.29 -55.82 28.58 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.605 0.717 . . . . 0.0 111.004 171.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -52.98 -28.79 25.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.005 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' 1026 ' ' HIS . 77.4 t -74.11 -41.64 51.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 119.619 -0.229 . . . . 0.0 111.519 173.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.747 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -61.53 -46.93 87.85 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.09 177.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -53.77 -40.46 66.25 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.79 169.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 88.6 tttt -77.37 -35.04 54.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.424 0.631 . . . . 0.0 110.246 -172.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.453 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -75.41 -45.57 38.1 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.988 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 1.042 ' HG ' HD11 ' A' ' 991' ' ' LEU . 3.4 tm? -67.99 -33.68 75.09 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.96 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' 1040 ' ' ASP . 4.2 pp -64.74 -29.34 70.32 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.48 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 20.8 t70 -84.98 -37.67 20.17 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.887 0.742 . . . . 0.0 109.511 178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.758 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 5.7 t -52.88 -52.97 23.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.654 172.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.808 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 24.4 pt -90.48 -22.77 6.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.885 ' HA ' ' OD1' ' A' ' 922' ' ' ASN . 6.2 t70 -44.81 -49.26 10.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 157.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 28.3 mt-30 -78.44 -27.33 46.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.481 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.808 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.68 -56.12 22.53 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 118.333 0.515 . . . . 0.0 111.46 175.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.608 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.1 OUTLIER -57.82 -32.3 67.45 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.336 176.49 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.87 -13.1 59.99 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.762 174.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.7 mmtp -73.24 -35.47 66.26 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 59.8 ttm -66.42 -40.65 89.66 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.669 173.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.03 -35.0 62.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.794 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 22.3 t -70.12 -33.87 72.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.02 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 21.9 tp60 . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.743 -178.464 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.678 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 2.1 tpm_? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 35.2 t 73.53 -0.24 3.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.035 0.534 . . . . 0.0 111.668 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.4 OUTLIER 52.54 68.75 0.78 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-O 121.598 0.714 . . . . 0.0 111.247 175.12 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 925' ' ' VAL . 45.3 t0 -45.1 -171.78 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 112.105 -2.316 . . . . 0.0 112.687 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.688 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.3 tmtp? -34.9 -21.44 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.392 1.077 . . . . 0.0 113.007 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.817 HG21 ' HB2' ' A' 1043 ' ' ARG . 0.5 OUTLIER -56.36 -56.17 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 172.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -78.02 -30.54 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.156 0.979 . . . . 0.0 108.527 -177.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 86.4 mt-10 -60.31 -50.92 71.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.978 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.493 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 32.3 t-20 -66.1 -44.46 84.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.346 -174.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' 1036 ' ' LEU . 4.1 t -62.44 -30.97 50.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.057 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.539 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 56.4 m -64.05 -34.77 78.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.881 0.848 . . . . 0.0 109.146 171.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.95 -28.0 62.94 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.85 172.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.998 HD12 HD13 ' A' ' 965' ' ' LEU . 3.7 tt -66.92 -49.17 66.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 117.455 0.627 . . . . 0.0 109.745 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 937' ' ' ILE . 3.4 m -63.01 -32.24 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.895 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.539 ' HD2' ' O ' ' A' ' 930' ' ' THR . 1.3 mpmm? -65.07 -28.41 69.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.854 0.359 . . . . 0.0 110.994 174.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.664 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.14 -26.03 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 0.0 111.265 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.574 ' HA ' HG12 ' A' ' 958' ' ' VAL . 9.7 p -80.81 -10.43 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.124 172.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.7 mm -71.86 -36.87 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 166.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 41.2 mt-10 -57.74 -45.05 86.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.668 170.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.58 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.2 -45.2 91.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.682 176.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.732 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.9 t -64.27 -37.98 89.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.308 -177.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.573 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.5 p -77.11 -38.87 51.3 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 -176.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.646 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.7 mmtp -52.87 -49.96 64.79 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.683 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.738 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.2 tt -71.1 -23.74 23.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.811 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 84.7 mm-40 -59.38 -64.75 2.6 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -175.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.811 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -101.29 5.55 0.59 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.667 1.578 . . . . 0.0 113.832 -174.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -110.62 157.22 38.98 Favored Pre-proline 0 C--N 1.323 -0.572 0 C-N-CA 120.627 -0.429 . . . . 0.0 112.098 -173.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.99 176.37 9.46 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.417 2.744 . . . . 0.0 112.237 177.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.719 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 77.7 Cg_exo -53.29 -24.93 28.72 Favored 'Trans proline' 0 C--O 1.245 0.863 0 C-N-CA 123.318 2.679 . . . . 0.0 113.289 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -54.55 -31.27 56.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.097 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.553 ' OE1' ' HE2' ' A' ' 942' ' ' LYS . 10.7 mm-40 -100.96 1.18 39.48 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.323 178.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.719 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 13.7 m-30 -64.27 -39.01 93.07 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 172.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.037 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -73.18 -51.22 6.08 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.591 174.856 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.007 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.3 Cg_exo -51.62 -36.86 62.24 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.157 1.905 . . . . 0.0 114.742 172.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.738 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 26.4 ptt? -62.71 -46.99 85.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.394 0.616 . . . . 0.0 110.054 -177.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.586 ' O ' HG22 ' A' ' 958' ' ' VAL . 89.4 t -68.21 -26.55 34.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 173.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 87.3 tttt -58.75 -38.11 77.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 6.1 mm-40 -55.37 -46.88 76.45 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.855 174.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.5 m -74.24 -22.35 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 O-C-N 122.202 -0.311 . . . . 0.0 111.829 177.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.566 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.48 -44.0 66.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.135 -1.031 . . . . 0.0 111.479 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.3 mm? -64.42 -27.78 69.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.588 0.232 . . . . 0.0 110.768 171.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.686 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.62 -56.91 16.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.218 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 991' ' ' LEU . 5.1 tt -63.03 -36.57 84.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.191 -0.204 . . . . 0.0 111.057 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 46.1 ttt180 -59.85 -53.47 57.51 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 176.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.8 m -55.92 -40.9 73.76 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.848 0.832 . . . . 0.0 109.914 174.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.998 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -60.78 -29.51 69.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.851 176.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.436 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.1 tp -68.03 -29.56 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.549 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.33 -38.33 90.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.352 0.596 . . . . 0.0 109.668 173.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.754 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.3 m -71.2 -33.69 70.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.101 174.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 965' ' ' LEU . 78.6 t -55.12 -30.99 24.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.537 171.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.49 ' HA ' ' HB2' ' A' ' 973' ' ' LEU . 24.6 t70 -77.87 -26.23 49.12 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 177.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.549 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.5 mm-40 -65.91 -54.25 28.93 Favored 'General case' 0 C--O 1.25 1.079 0 CA-C-O 123.344 1.545 . . . . 0.0 108.514 170.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.439 ' O ' HD13 ' A' ' 976' ' ' LEU . 46.6 t -62.84 -26.94 69.0 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.657 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.761 ' HA ' HD13 ' A' ' 976' ' ' LEU . 4.9 tt -57.33 -52.99 70.09 Favored Pre-proline 0 N--CA 1.472 0.674 0 CA-C-O 118.597 -0.716 . . . . 0.0 112.421 -174.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 51.7 Cg_exo -55.19 -30.75 72.82 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.178 1.456 . . . . 0.0 110.541 170.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 2.6 t -77.05 -13.71 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.618 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.878 ' HG ' HG21 ' A' ' 984' ' ' ILE . 5.8 mp -61.72 -64.45 3.07 Favored Pre-proline 0 N--CA 1.472 0.66 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.8 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.741 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 17.3 Cg_endo -58.21 -28.19 83.24 Favored 'Trans proline' 0 C--N 1.364 1.361 0 C-N-CA 121.505 1.47 . . . . 0.0 111.291 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . 0.629 ' O ' ' HG3' ' A' 1049 ' ' GLN . . . -59.52 -52.2 66.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.513 173.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 1.052 ' HB3' ' HB3' ' A' 1045 ' ' LYS . 3.5 t -171.58 -33.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.034 0.445 . . . . 0.0 112.044 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.985 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.0 m -63.81 -22.19 66.79 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -172.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.448 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.8 t-80 -53.21 -21.56 5.38 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -175.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -76.1 -54.78 6.33 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.162 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.762 ' CG ' HG22 ' A' 1038 ' ' VAL . 3.4 tp10 -74.49 -43.14 57.35 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.426 -0.509 . . . . 0.0 111.374 -178.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.985 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.2 OUTLIER -59.45 -37.71 71.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -174.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.27 -43.88 83.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.543 174.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.696 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.8 ptm -63.02 -47.91 81.04 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.143 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.791 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -79.44 -43.54 23.09 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.839 ' HA ' HD12 ' A' ' 991' ' ' LEU . 61.5 tt0 -60.27 -45.98 91.42 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.974 -0.291 . . . . 0.0 111.544 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -66.54 -31.02 71.47 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.413 ' HG ' ' HB2' ' A' 1031 ' ' ASP . 1.8 tp -65.93 -40.39 91.36 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.359 175.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.043 HD11 HD22 ' A' 1035 ' ' LEU . 18.5 mt -58.07 -56.28 24.13 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.519 0.676 . . . . 0.0 110.557 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.99 -31.8 63.36 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.75 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.5 m -76.07 -36.34 59.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.838 -177.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -102.55 -31.47 10.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.06 -174.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.876 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.5 tm? -59.41 -41.25 89.06 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 168.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -63.61 -44.63 93.37 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.152 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.52 ' O ' ' HD3' ' A' 1001 ' ' LYS . 19.2 mm-40 -53.14 -43.33 66.9 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.681 173.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' 1028 ' ' LEU . 2.4 mt -67.26 -28.97 68.47 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.74 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 995' ' ' LEU . 44.0 mm -66.23 -43.21 91.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.837 177.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.589 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.2 m-20 -79.31 -15.2 58.31 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.853 177.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.52 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -87.17 -36.83 17.81 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.204 0.315 . . . . 0.0 111.371 178.464 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.037 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -65.71 -39.48 91.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 169.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 58.9 tttm -62.56 -53.31 56.54 Favored 'General case' 0 C--O 1.204 -1.322 0 CA-C-N 114.021 -1.445 . . . . 0.0 108.511 174.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' 1000 ' ' ASN . 21.5 tp -49.29 -56.38 9.64 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.352 1.061 . . . . 0.0 113.489 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.84 -45.85 89.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.479 0.657 . . . . 0.0 110.18 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.4 pp0? -76.54 -11.06 59.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.086 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -81.27 -40.31 23.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.267 -176.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.545 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 11.7 m-85 . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.807 177.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.501 ' HA ' ' HD2' ' A' 1017 ' ' TYR . 0.7 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -55.07 -34.83 63.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.555 ' HG2' ' CE1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -48.05 -50.31 28.43 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.825 0.821 . . . . 0.0 110.882 168.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.588 ' HB3' ' HG ' ' A' 1004 ' ' LEU . 14.5 m-85 -78.98 -20.06 50.08 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.668 -175.301 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.507 ' O ' ' HG ' ' A' 1022 ' ' LEU . 19.0 ttmm -72.34 -33.13 67.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.211 169.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.416 ' HB3' ' HE3' ' A' 1019 ' ' LYS . 20.6 mmmt -74.42 -56.67 4.59 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.566 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.511 ' HG3' ' O ' ' A' 1016 ' ' GLU . 44.2 mt-30 -50.8 -31.7 17.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.466 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 14.9 tmm? -67.85 -45.95 73.14 Favored 'General case' 0 C--O 1.23 0.06 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.266 175.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' 1018 ' ' LYS . 95.8 mt -60.54 -40.14 90.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.874 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 24.8 m -62.59 -34.17 76.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 0.0 110.582 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.42 -42.04 31.23 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.069 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.504 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -61.83 -38.43 88.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.05 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.6 ' O ' HG23 ' A' 1030 ' ' VAL . 19.0 t-80 -69.08 -47.92 64.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.375 178.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.14 -34.94 75.8 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.441 0.463 . . . . 0.0 110.427 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.7 OUTLIER -63.12 -50.05 72.0 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.685 0.755 . . . . 0.0 110.385 174.688 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.56 -37.53 68.13 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.053 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 1026 ' ' HIS . 57.2 t -67.57 -30.57 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.7 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -75.14 -39.35 60.55 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.711 -0.795 . . . . 0.0 109.029 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.423 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.19 -53.16 59.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.19 172.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.521 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 27.0 mtpp -61.89 -39.73 92.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.814 -177.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.625 ' O ' HG23 ' A' 1038 ' ' VAL . 7.4 t30 -68.55 -38.01 80.43 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.111 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 1.043 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.36 -26.08 46.56 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.09 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.57 ' HB3' ' HB ' ' A' ' 929' ' ' VAL . 4.4 pp -74.11 -21.57 59.84 Favored 'General case' 0 C--O 1.211 -0.944 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.433 ' O ' ' HG3' ' A' 1041 ' ' GLN . 3.9 m-20 -82.23 -46.53 13.59 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 123.967 0.792 . . . . 0.0 109.163 170.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.791 HG21 ' HB2' ' A' ' 987' ' ' ALA . 29.0 t -50.6 -57.07 2.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.482 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.812 ' CG2' ' HB ' ' A' ' 925' ' ' VAL . 17.2 mt -73.36 -35.97 47.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.95 -177.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' 1036 ' ' LEU . 5.0 t70 -50.98 -45.46 60.96 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 166.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.9 mt-30 -72.57 -29.34 63.45 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.09 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' 1045 ' ' LYS . . . -54.03 -58.03 8.82 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 121.043 0.449 . . . . 0.0 111.777 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.817 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.6 OUTLIER -59.51 -28.83 67.41 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.356 177.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 40.1 tp -77.42 -25.82 51.1 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.451 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 1.052 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 3.6 mmpm? -63.33 -33.59 75.86 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.855 0.836 . . . . 0.0 109.091 175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.9 ttt -64.72 -43.6 92.91 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.301 -1.318 . . . . 0.0 109.275 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.496 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.1 mm -60.85 -43.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.0 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' 1045 ' ' LYS . 66.3 m -53.97 -29.61 43.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.219 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' ' 978' ' ' ALA . 26.5 mm-40 . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -176.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 1.018 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 38.2 m 74.27 22.75 2.17 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.888 0.742 . . . . 0.0 111.034 -174.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 1.018 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 44.02 55.65 5.2 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.999 176.091 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 925' ' ' VAL . 14.0 m-20 -46.52 -175.15 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.487 0 O-C-N 125.121 1.513 . . . . 0.0 112.582 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.556 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 5.4 tmtp? -33.06 -24.76 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.667 1.187 . . . . 0.0 113.243 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.799 HG21 ' HB2' ' A' 1043 ' ' ARG . 4.9 m -61.85 -53.38 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-O 119.194 -0.431 . . . . 0.0 112.081 175.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.601 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 71.2 t80 -78.4 -27.29 46.69 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.546 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.5 mt-10 -64.97 -61.12 2.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.901 -178.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.556 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -70.02 -34.53 73.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.11 -172.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.96 ' HB ' HD11 ' A' 1039 ' ' ILE . 12.7 p -62.36 -34.76 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.816 175.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.543 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -68.1 -35.36 78.03 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.94 -28.39 63.46 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.416 172.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.66 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.5 tt -63.39 -42.93 98.83 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 175.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 937' ' ' ILE . 42.4 t -63.97 -38.12 81.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.263 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 934' ' ' LYS . 10.5 mmpt? -65.11 -33.95 77.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.992 0.425 . . . . 0.0 110.469 177.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -76.2 -26.13 55.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.338 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.722 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -83.38 -14.14 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.673 173.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.591 HG12 ' O ' ' A' ' 933' ' ' VAL . 39.7 mm -70.08 -35.79 65.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 166.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.609 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 46.5 mt-10 -54.35 -43.65 71.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.365 170.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.641 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.2 ttp -58.46 -43.59 88.93 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.596 0.56 . . . . 0.0 110.356 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.576 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 16.7 m -65.6 -37.18 85.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.093 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.6 m -77.3 -43.06 34.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -177.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.695 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.4 mmtm -49.94 -57.65 7.05 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.601 -1.636 . . . . 0.0 111.259 176.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 12.9 tt -62.5 -29.27 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.786 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.5 mt-30 -50.29 -60.69 4.8 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.786 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 18.1 Cg_endo -93.37 0.94 3.44 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.499 1.466 . . . . 0.0 113.879 177.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.884 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -90.16 148.43 39.3 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.57 175.34 6.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.902 3.068 . . . . 0.0 110.064 165.153 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.641 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 9.9 Cg_endo -51.87 -31.01 40.94 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.742 2.295 . . . . 0.0 112.511 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.54 -33.27 67.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.081 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.884 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -98.73 -0.27 43.11 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 122.953 0.158 . . . . 0.0 111.297 175.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.726 ' O ' ' HG2' ' A' ' 954' ' ' MET . 10.1 m-30 -65.55 -37.84 87.88 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 175.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.094 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -78.42 -45.16 2.08 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.163 173.447 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.094 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.4 Cg_exo -53.81 -28.43 47.94 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.829 1.686 . . . . 0.0 113.999 170.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 16.6 ptt? -72.87 -37.89 67.21 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.465 178.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.785 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -64.82 -26.49 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.702 171.494 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 55.7 tttt -57.0 -40.77 77.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -55.67 -46.17 77.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.49 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 936' ' ' VAL . 1.6 m -72.77 -22.7 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 120.798 0.332 . . . . 0.0 111.179 176.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.57 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.28 -44.27 66.56 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.175 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.2 mm? -63.78 -24.07 67.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.948 172.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -61.1 -57.82 10.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.324 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.69 ' HB2' HD13 ' A' ' 995' ' ' LEU . 22.8 tp -68.71 -34.42 75.61 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.637 -0.425 . . . . 0.0 112.016 178.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 959' ' ' GLY . 75.1 mtp180 -59.57 -55.23 37.1 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.772 -0.58 . . . . 0.0 112.437 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.44 HG22 ' OD1' ' A' ' 928' ' ' ASN . 14.7 m -57.88 -34.7 70.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.584 0.707 . . . . 0.0 110.242 174.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.674 HD11 HD21 ' A' 1035 ' ' LEU . 3.0 tm? -63.81 -29.0 70.24 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.235 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.476 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 0.2 OUTLIER -66.94 -28.16 68.06 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.687 -178.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.06 89.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.381 0.61 . . . . 0.0 109.836 172.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.747 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.3 m -58.55 -39.68 80.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.61 172.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.555 HG13 HD11 ' A' ' 984' ' ' ILE . 72.7 t -54.07 -30.55 20.22 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.307 174.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.2 t70 -74.65 -24.06 58.77 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.59 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.6 mm-40 -71.91 -51.22 23.28 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.83 1.3 . . . . 0.0 109.135 169.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.422 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 30.9 t -65.45 -24.56 67.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.803 -1.544 . . . . 0.0 111.056 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.652 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 28.4 tp -63.76 -50.17 72.61 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-O 118.468 -0.777 . . . . 0.0 112.454 -175.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.613 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.8 Cg_exo -59.23 -26.49 81.98 Favored 'Trans proline' 0 C--N 1.356 0.964 0 CA-C-N 121.096 1.427 . . . . 0.0 110.827 169.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' 1042 ' ' ALA . 38.7 t -75.09 -16.71 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.726 174.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.813 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 0.3 OUTLIER -64.57 -54.85 33.78 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.81 176.231 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 29.2 Cg_exo -62.2 -25.61 77.09 Favored 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 120.962 1.379 . . . . 0.0 110.406 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -68.11 -61.6 1.78 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.656 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.896 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 9.6 m -163.45 -50.22 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -172.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.529 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 4.9 t -53.28 -15.99 1.15 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -172.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.813 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 8.9 p-80 -47.94 -20.78 0.35 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 982' ' ' ARG . 9.1 tpt180 -76.86 -52.24 9.83 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.465 -0.894 . . . . 0.0 110.488 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.989 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.0 OUTLIER -76.61 -39.07 53.61 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.757 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' ' 981' ' ' HIS . 10.6 tt -63.06 -25.35 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.891 -176.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -73.5 -40.85 63.75 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.303 171.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.597 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 15.7 ptp -70.9 -51.2 27.63 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.842 -0.743 . . . . 0.0 112.052 -173.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.554 ' CB ' HG21 ' A' 1038 ' ' VAL . . . -78.76 -40.12 34.22 Favored 'General case' 0 C--O 1.217 -0.625 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' A' ' 991' ' ' LEU . 6.6 tt0 -61.56 -44.75 96.46 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.208 -177.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.43 -26.18 64.48 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.572 0.701 . . . . 0.0 109.136 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 8.6 tp -72.25 -37.35 69.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.823 178.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.036 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.4 mt -61.58 -53.42 56.5 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.982 176.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -57.03 -37.49 71.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.494 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 4.5 p -71.65 -38.03 70.75 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -176.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.639 ' HA ' ' HB3' ' A' ' 997' ' ' GLU . 4.3 m-20 -106.77 -31.13 8.54 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 119.529 -0.868 . . . . 0.0 112.825 -172.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.017 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.7 OUTLIER -59.79 -45.46 92.22 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.24 91.16 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.848 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.728 ' O ' ' HB2' ' A' 1001 ' ' LYS . 7.7 tp10 -53.03 -41.07 64.36 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.056 174.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.667 HD23 HD13 ' A' 1028 ' ' LEU . 40.9 tp -68.31 -38.99 82.14 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.243 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.785 ' HA ' HG11 ' A' ' 955' ' ' VAL . 77.7 mt -57.57 -51.21 72.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.298 0.57 . . . . 0.0 110.64 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.639 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -78.47 -11.72 59.97 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.531 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.728 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 0.8 OUTLIER -84.42 -32.95 23.83 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.311 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 998' ' ' LEU . 43.7 mmm -78.71 -39.49 36.33 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' 1007 ' ' GLN . 84.1 tttt -55.79 -51.01 68.91 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.536 -1.211 . . . . 0.0 108.488 169.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.7 tp -57.28 -46.2 83.33 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.422 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -60.57 -44.48 96.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.385 0.612 . . . . 0.0 110.35 178.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.0 pp0? -76.68 -10.66 59.54 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.446 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.6 tp-100 -87.95 -16.71 33.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.413 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 60.9 t80 . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.951 -176.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.527 0.081 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.702 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 19.7 pt20 -61.69 -32.28 72.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.453 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -50.44 -42.87 54.75 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 111.602 0.223 . . . . 0.0 111.602 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.609 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 4.5 m-30 -84.6 -19.62 32.74 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.225 0.536 . . . . 0.0 110.219 178.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.7 tttm -75.37 -32.11 60.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.49 177.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -76.44 -41.2 48.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -48.46 -40.14 25.3 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.554 166.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.623 ' HB3' ' O ' ' A' 1018 ' ' LYS . 1.3 tmt? -57.22 -46.71 82.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.252 173.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.57 -38.4 89.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.36 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.1 m -68.51 -37.08 79.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.894 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.91 -41.57 36.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.643 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.571 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -63.05 -31.79 73.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.258 0.552 . . . . 0.0 110.497 178.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' 1030 ' ' VAL . 6.0 t60 -71.64 -44.13 64.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.775 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.86 94.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.698 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 995' ' ' LEU . 5.5 tt -55.63 -53.53 55.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.178 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.77 -31.09 64.27 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.573 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.748 ' HA ' ' HG2' ' A' 1033 ' ' LYS . 80.6 t -66.06 -43.51 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.867 174.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.561 ' HB3' HD23 ' A' ' 991' ' ' LEU . 8.4 m-20 -51.35 -46.4 62.68 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.05 0.452 . . . . 0.0 109.838 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.652 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -60.9 -53.25 59.54 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.117 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.748 ' HG2' ' HA ' ' A' 1030 ' ' VAL . 15.0 ptmm? -65.75 -32.14 73.52 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -174.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.677 ' O ' HG23 ' A' 1038 ' ' VAL . 4.8 t30 -73.43 -36.85 66.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.511 -0.475 . . . . 0.0 109.998 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.91 HD22 HD11 ' A' ' 991' ' ' LEU . 9.9 tp -79.81 -26.96 40.34 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.713 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.9 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.9 pp -64.79 -27.11 68.67 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.557 ' O ' ' HG2' ' A' 1041 ' ' GLN . 31.4 t70 -75.31 -45.91 36.7 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.219 -1.355 . . . . 0.0 108.921 170.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.989 HG13 ' HB3' ' A' ' 983' ' ' GLU . 55.7 t -53.31 -61.27 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.758 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.107 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.96 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.8 pt -81.33 -32.7 12.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -172.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 8.6 t0 -54.6 -44.53 73.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.201 166.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' A' 1045 ' ' LYS . 27.3 pt20 -78.47 -22.61 47.27 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.852 177.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.624 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.58 -55.35 30.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 118.478 0.581 . . . . 0.0 110.064 169.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.799 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.0 tpt180 -55.56 -33.86 64.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.131 175.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.507 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 66.1 tp -76.56 -26.3 54.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.439 175.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.896 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 69.0 mmtt -64.24 -34.63 78.55 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.0 ttp -71.41 -40.87 70.22 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.804 -1.543 . . . . 0.0 109.203 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.494 ' HB ' HD12 ' A' 1044 ' ' LEU . 48.6 mm -62.32 -35.02 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.809 172.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' 1045 ' ' LYS . 31.2 t -60.7 -40.19 91.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.316 -175.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 15.1 mm100 . . . . . 0 C--N 1.325 -0.457 0 C-N-CA 120.561 -0.455 . . . . 0.0 111.621 -177.0 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.84 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 6.7 tpt180 . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -75.73 39.88 0.18 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.757 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.794 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.1 OUTLIER 43.32 69.93 0.35 Allowed 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 124.229 1.011 . . . . 0.0 111.801 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 925' ' ' VAL . 2.1 t70 -47.02 -173.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 O-C-N 126.042 2.089 . . . . 0.0 113.058 -171.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.543 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 0.6 OUTLIER -46.54 -12.11 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.605 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.744 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -65.4 -54.65 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.751 171.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.458 ' CD1' ' HB2' ' A' 1040 ' ' ASP . 52.2 t80 -78.88 -29.13 44.21 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 122.144 0.973 . . . . 0.0 108.64 -176.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 38.5 mt-10 -65.41 -62.47 1.51 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.075 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.487 HD21 HG22 ' A' ' 964' ' ' THR . 57.3 t30 -71.56 -32.52 68.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.985 -170.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.877 HG23 HD11 ' A' ' 965' ' ' LEU . 14.4 p -60.6 -38.02 77.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.44 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.546 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 55.6 m -65.49 -32.85 74.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 172.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.82 -33.2 67.44 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.866 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.533 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 21.0 tp -62.7 -43.0 99.93 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 117.383 0.591 . . . . 0.0 109.43 174.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 937' ' ' ILE . 27.4 t -63.53 -42.08 94.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.689 176.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.581 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.9 mmpt? -65.27 -31.01 71.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.02 -25.14 43.27 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.479 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.64 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.7 p -81.99 -11.32 12.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 C-N-CA 119.728 -0.789 . . . . 0.0 109.228 171.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 46.5 mm -72.34 -36.19 54.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 165.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.6 mm-40 -53.15 -38.05 62.39 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.372 170.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.511 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 57.5 ttp -58.16 -45.45 87.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.793 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.611 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 48.3 m -65.46 -33.07 75.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.666 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.765 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.2 m -77.46 -37.03 52.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.986 0.898 . . . . 0.0 108.943 -177.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.2 mmtp -70.01 -29.7 66.82 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.901 -1.499 . . . . 0.0 111.671 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 1.035 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 15.4 tt -79.49 -23.29 12.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.318 0.58 . . . . 0.0 110.462 178.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 940' ' ' SER . 84.2 mm-40 -55.27 -56.02 33.2 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 941' ' ' SER . 13.4 Cg_endo -91.31 -4.08 4.35 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.766 1.644 . . . . 0.0 115.421 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 950' ' ' GLU . . . -129.86 162.0 56.15 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.544 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 3.2 Cg_exo -80.61 -178.83 4.7 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 124.283 3.322 . . . . 0.0 110.908 168.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.929 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 5.9 Cg_endo -47.59 -18.37 0.9 Allowed 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 124.712 3.608 . . . . 0.0 115.689 -168.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.38 -4.18 1.73 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 170.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 1.035 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.1 OUTLIER -96.03 -27.87 14.9 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 173.155 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.929 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 11.1 m-85 -43.53 -47.36 7.28 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.046 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -69.75 -59.58 4.48 Favored Pre-proline 0 CA--C 1.555 1.152 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.814 177.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.046 ' HD3' HG13 ' A' ' 952' ' ' VAL . 51.2 Cg_exo -59.33 -35.92 95.66 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.338 2.026 . . . . 0.0 114.873 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.73 ' HE2' ' HA ' ' A' ' 951' ' ' TYR . 24.0 ptt? -64.01 -47.61 79.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -177.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' 1002 ' ' MET . 72.0 t -66.32 -27.0 39.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.55 174.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 88.2 tttt -62.71 -38.34 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.5 mm-40 -54.04 -45.37 71.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.883 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.656 ' HB ' HD21 ' A' ' 998' ' ' LEU . 1.9 t -71.71 -22.61 21.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.022 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.623 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.62 -45.79 34.37 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.109 -178.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.03 -21.61 66.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.826 0.346 . . . . 0.0 110.483 171.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 958' ' ' VAL . . . -62.34 -56.91 13.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.995 178.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 991' ' ' LEU . 8.3 tt -70.66 -27.26 63.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.195 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -54.51 45.12 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.022 170.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.487 HG22 HD21 ' A' ' 928' ' ' ASN . 24.8 m -53.89 -38.55 64.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.599 174.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.877 HD11 HG23 ' A' ' 929' ' ' VAL . 0.4 OUTLIER -64.33 -29.6 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.418 178.695 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.423 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 34.5 tp -63.97 -31.95 73.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.507 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.49 91.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.558 0.694 . . . . 0.0 110.045 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.744 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.9 m -62.99 -39.0 93.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.423 173.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 87.0 t -54.88 -31.73 25.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.286 174.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.531 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 0.9 OUTLIER -73.95 -23.19 59.46 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 176.62 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.637 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.4 mm-40 -67.62 -52.92 32.54 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 122.71 1.243 . . . . 0.0 109.001 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 9.6 p -66.8 -23.08 66.02 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.233 -1.348 . . . . 0.0 111.206 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.693 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 37.8 tp -55.76 -53.76 59.22 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-O 118.921 -0.561 . . . . 0.0 112.077 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 37.5 Cg_exo -61.09 -24.64 79.76 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.336 1.357 . . . . 0.0 111.246 170.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.691 HG12 ' HB ' ' A' ' 980' ' ' THR . 38.3 t -74.49 -13.94 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.334 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 1.015 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.3 tt -70.34 -53.16 10.72 Favored Pre-proline 0 C--O 1.234 0.27 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.407 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.529 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 33.9 Cg_exo -61.24 -25.5 80.71 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.178 1.252 . . . . 0.0 110.96 173.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.08 -64.97 0.77 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.22 174.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.833 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.4 m -163.46 -35.28 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -173.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 1.0 OUTLIER -61.47 -14.11 26.21 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -171.574 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 1.015 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 9.7 p-80 -50.15 -19.16 0.7 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -172.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.506 ' HE ' ' HA ' ' A' ' 982' ' ' ARG . 2.6 tpm_? -73.8 -52.72 12.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.58 176.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.925 ' HB3' HG13 ' A' 1038 ' ' VAL . 3.1 mp0 -77.05 -43.95 32.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.785 HD11 HG13 ' A' ' 969' ' ' VAL . 9.8 tp -56.97 -30.13 33.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.65 -174.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 10.5 mm-40 -73.02 -45.13 59.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.38 172.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.692 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 14.3 ptp -62.72 -54.41 39.61 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.648 -170.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.77 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -74.88 -35.55 62.3 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.14 -176.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.885 ' HA ' HD12 ' A' ' 991' ' ' LEU . 6.4 tp-100 -59.59 -40.27 86.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.716 -176.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.721 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 69.1 mmtt -61.24 -42.35 98.46 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -65.75 -38.3 88.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.292 179.129 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.887 ' HB3' HD11 ' A' ' 962' ' ' LEU . 21.3 mt -61.8 -47.03 86.97 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.428 0.632 . . . . 0.0 109.888 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -57.81 -46.18 85.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.54 -177.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.7 p -70.81 -38.2 73.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.842 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 1.2 m-20 -91.42 -42.14 10.48 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -168.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.6 tm? -59.92 -40.45 88.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 171.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.48 69.63 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.97 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 9.8 pt-20 -68.71 -28.86 67.21 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.663 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.843 HD22 HD13 ' A' 1028 ' ' LEU . 1.1 tp -56.97 -49.56 75.32 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.523 175.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.639 ' O ' ' HG3' ' A' 1002 ' ' MET . 29.7 pt -73.55 -24.71 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 120.849 0.356 . . . . 0.0 111.471 -179.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.69 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.4 m-80 -87.12 -1.11 57.65 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 121.96 -0.463 . . . . 0.0 109.869 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 1.0 ' HD2' ' HA ' ' A' 1021 ' ' MET . 5.5 ttpm? -82.99 -37.42 24.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.943 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -73.57 -37.64 65.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 173.151 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 53.8 tptt -56.63 -57.84 10.64 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.37 171.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.782 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 10.7 tp -55.29 -55.26 33.49 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.4 81.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 110.723 -177.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.7 -13.26 60.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.526 0.679 . . . . 0.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.7 tp-100 -79.79 -31.6 40.81 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.107 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.567 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 67.0 t80 . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.12 -176.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? . . . . . 0 N--CA 1.453 -0.3 0 CA-C-O 120.852 0.358 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.812 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 26.2 tt0 -60.55 -32.42 71.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.107 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.29 -43.77 22.68 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.262 169.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.782 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 7.2 m-30 -87.07 -7.36 58.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.083 0.468 . . . . 0.0 110.495 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.812 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 30.3 tptt -75.64 -26.41 57.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.654 169.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 67.7 mttm -72.35 -57.24 4.36 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -47.97 -35.56 11.02 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.471 169.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 1.0 ' HA ' ' HD2' ' A' 1001 ' ' LYS . 7.9 tpt -51.68 -48.69 63.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.263 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.54 -53.4 23.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.647 0.26 . . . . 0.0 110.851 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 15.2 m -59.95 -46.22 90.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.124 -174.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.853 ' HB3' ' HD3' ' A' 1001 ' ' LYS . . . -74.59 -31.97 62.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.689 0.28 . . . . 0.0 111.681 -173.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.638 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -75.47 -37.54 60.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.956 0.408 . . . . 0.0 110.451 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 26.5 t60 -70.38 -30.3 67.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.278 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -68.95 -34.76 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.376 176.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.843 HD13 HD22 ' A' ' 998' ' ' LEU . 0.6 OUTLIER -63.95 -42.47 97.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 122.145 0.974 . . . . 0.0 109.715 173.118 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.9 -33.56 64.75 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.349 176.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' 1027 ' ' ALA . 82.6 t -66.63 -33.77 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 172.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.737 ' HB2' HD23 ' A' ' 991' ' ' LEU . 1.9 p30 -72.36 -38.78 68.45 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.476 ' HB2' HD23 ' A' ' 932' ' ' LEU . . . -61.15 -44.72 96.87 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.692 171.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.651 ' O ' ' HG ' ' A' 1036 ' ' LEU . 60.0 tttm -63.76 -42.13 97.88 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.792 -176.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.599 ' O ' HG23 ' A' 1038 ' ' VAL . 66.1 t30 -73.2 -40.01 65.09 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.375 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.774 ' O ' HG12 ' A' 1039 ' ' ILE . 18.1 tp -73.76 -31.65 63.43 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.597 -177.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.84 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.3 pp -62.29 -37.02 83.92 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.481 ' N ' HD12 ' A' 1036 ' ' LEU . 29.2 t70 -75.67 -37.92 59.18 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.386 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.925 HG13 ' HB3' ' A' ' 983' ' ' GLU . 4.8 t -53.59 -59.07 2.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.98 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.81 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.5 pt -85.83 -24.73 6.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.153 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.458 ' HB2' ' CD1' ' A' ' 926' ' ' TYR . 19.7 t70 -61.08 -39.27 89.3 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.475 162.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.719 ' O ' ' HG2' ' A' 1045 ' ' LYS . 35.7 mt-30 -68.21 -35.08 77.42 Favored 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.393 171.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.629 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.98 -49.49 71.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.122 0.487 . . . . 0.0 110.717 174.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.84 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -47.4 -41.46 20.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.624 172.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.527 ' N ' ' HD3' ' A' 1043 ' ' ARG . 26.3 tp -79.97 -32.44 39.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.278 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.833 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 31.6 mmtp -63.13 -42.18 99.46 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.325 0.583 . . . . 0.0 109.973 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 25.6 ttt -69.12 -33.65 73.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.81 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.587 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 31.6 mm -69.53 -41.86 80.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.934 173.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 70.5 m -54.38 -28.03 40.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.615 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 2.2 tpm_? . . . . . 0 N--CA 1.449 -0.495 0 CA-C-O 120.742 0.306 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.403 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 38.3 m -123.59 46.14 2.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.684 -174.199 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 44.9 55.95 5.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.881 0.872 . . . . 0.0 112.934 173.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.612 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 23.8 t0 -47.8 -175.05 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.717 0 O-C-N 125.399 1.687 . . . . 0.0 111.845 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.491 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.2 tmtm? -37.0 -21.02 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.12 0.968 . . . . 0.0 112.874 -179.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.887 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 6.9 m -59.69 -51.44 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 O-C-N 122.144 -0.348 . . . . 0.0 111.299 173.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 27.4 t80 -75.63 -31.89 60.03 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -173.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.76 -58.07 7.23 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.874 -1.512 . . . . 0.0 111.651 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -70.6 -30.43 67.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.123 -173.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.673 HG22 HD11 ' A' ' 965' ' ' LEU . 61.2 t -66.19 -41.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.973 -0.691 . . . . 0.0 109.884 175.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.686 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 67.3 m -60.19 -35.86 76.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 169.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -59.52 -33.96 79.1 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.519 174.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.709 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.3 tt -63.7 -45.9 87.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.8 t -57.09 -42.54 79.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.915 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.686 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -63.71 -40.85 97.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.418 178.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.717 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.16 -26.55 42.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.959 -177.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' A' ' 939' ' ' MET . 15.0 p -79.01 -14.53 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.697 0.761 . . . . 0.0 109.128 172.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 24.4 mm -69.83 -31.43 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 167.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.568 ' HG3' ' HA ' ' A' ' 935' ' ' ALA . 36.2 mt-10 -61.27 -39.05 88.97 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.939 174.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.749 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 43.6 ttp -51.37 -47.06 62.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.334 172.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.621 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.9 t -71.9 -39.18 69.74 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.048 178.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.453 ' HA ' HE21 ' A' ' 944' ' ' GLN . 46.7 m -71.71 -50.88 26.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.159 0.504 . . . . 0.0 110.564 -169.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.631 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -82.98 -11.48 58.1 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.566 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -77.17 -45.79 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.212 0.46 . . . . 0.0 111.378 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 940' ' ' SER . 0.1 OUTLIER -59.05 -46.81 99.42 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -173.349 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.609 ' HD3' ' HG3' ' A' ' 944' ' ' GLN . 79.2 Cg_endo -87.96 16.08 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.438 1.425 . . . . 0.0 113.545 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -125.72 154.26 73.15 Favored Pre-proline 0 C--N 1.328 -0.364 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.39 175.27 10.91 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 123.157 2.571 . . . . 0.0 111.821 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.966 ' HB3' HE21 ' A' 1006 ' ' GLN . 88.7 Cg_exo -50.24 -35.39 43.22 Favored 'Trans proline' 0 C--O 1.248 0.998 0 C-N-CA 123.118 2.545 . . . . 0.0 113.121 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -55.18 -25.27 31.45 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.857 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.696 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 53.3 mm-40 -106.94 -3.16 20.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.732 ' O ' ' HG3' ' A' ' 954' ' ' MET . 9.7 m-30 -61.31 -47.31 86.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 173.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.928 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.58 -44.01 12.2 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.876 177.019 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.928 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.5 Cg_exo -55.02 -29.72 66.34 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.805 1.67 . . . . 0.0 115.239 171.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 0.0 OUTLIER -72.95 -30.69 64.05 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.968 0.889 . . . . 0.0 109.644 178.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.784 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.6 OUTLIER -71.37 -26.2 26.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.003 174.455 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.651 ' HE3' ' HA ' ' A' ' 953' ' ' PRO . 8.6 mtmp? -58.15 -38.53 76.76 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.438 175.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' A' ' 957' ' ' GLU . 1.1 mm-40 -55.59 -45.98 77.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.711 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 2.2 t -65.42 -32.77 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.002 0.43 . . . . 0.0 110.788 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.79 -41.67 97.46 Favored Glycine 0 C--O 1.228 -0.232 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.775 177.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 62.6 tp -68.91 -33.47 73.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.242 0.544 . . . . 0.0 109.653 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.717 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -53.64 -57.07 12.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.766 177.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.953 HD22 ' HG ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -74.68 -21.13 59.57 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.578 -179.497 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -53.84 13.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.831 0.348 . . . . 0.0 110.322 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 7.0 m -58.22 -27.81 64.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.907 0.861 . . . . 0.0 109.488 173.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.673 HD11 HG22 ' A' ' 929' ' ' VAL . 17.4 tp -70.76 -37.27 73.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.889 178.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -51.01 -33.39 24.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.882 172.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -62.5 -48.84 77.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.798 0.332 . . . . 0.0 110.413 173.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.6 m -58.35 -46.1 86.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.306 173.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.794 HG13 HD11 ' A' ' 984' ' ' ILE . 96.6 t -52.43 -30.25 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.968 175.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.4 t70 -70.98 -29.06 64.94 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.289 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.623 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.5 mm-40 -65.57 -57.04 9.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.53 1.157 . . . . 0.0 109.036 172.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.492 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 53.0 p -58.5 -22.98 56.86 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.0 -1.0 . . . . 0.0 113.065 174.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.668 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 43.0 tp -56.83 -54.24 56.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.556 -179.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.668 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 52.3 Cg_exo -57.91 -23.71 60.95 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 121.6 1.533 . . . . 0.0 111.648 168.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.58 HG12 ' HB ' ' A' ' 980' ' ' THR . 44.0 t -74.89 -16.22 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.815 175.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 984' ' ' ILE . 1.0 OUTLIER -69.01 -48.08 28.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 118.973 -0.537 . . . . 0.0 111.641 176.688 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.528 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 39.9 Cg_exo -60.5 -26.51 82.96 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 121.156 1.237 . . . . 0.0 111.103 170.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . 0.631 ' HA ' ' OE1' ' A' 1049 ' ' GLN . . . -70.42 -66.6 0.58 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.803 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.832 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.0 m -165.46 -27.27 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -174.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.663 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 2.8 t -65.13 -12.81 54.97 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -172.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.551 ' CD2' ' HG3' ' A' ' 985' ' ' GLU . 3.7 t60 -45.8 -44.5 14.11 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 122.761 0.424 . . . . 0.0 111.621 -169.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -55.18 -53.53 54.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.038 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.0 OUTLIER -75.2 -43.45 51.88 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.794 HD11 HG13 ' A' ' 969' ' ' VAL . 11.3 tp -62.64 -26.62 41.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.297 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.551 ' HG3' ' CD2' ' A' ' 981' ' ' HIS . 1.3 mm-40 -74.08 -38.32 63.93 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.366 171.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 12.1 ptp -66.19 -62.44 1.48 Allowed 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.175 -174.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.705 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.23 -36.61 39.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -173.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.673 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.5 OUTLIER -69.47 -43.14 73.81 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.56 -175.064 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -66.36 -27.66 68.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.511 0.672 . . . . 0.0 109.244 173.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.559 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.8 tp -72.01 -39.92 68.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.494 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.852 HD11 HD22 ' A' 1035 ' ' LEU . 29.1 mt -59.76 -61.14 2.84 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.588 178.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -47.17 -37.8 10.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.113 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 71.0 m -67.43 -57.57 6.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.661 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.603 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 3.7 m-20 -93.66 -15.99 24.75 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.953 ' HG ' HD22 ' A' ' 962' ' ' LEU . 2.5 tm? -61.22 -50.6 72.41 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.626 1.103 . . . . 0.0 108.338 163.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.775 ' O ' ' HB3' ' A' 1000 ' ' ASN . . . -52.9 -30.73 35.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.544 172.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.71 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.8 tp10 -64.32 -45.24 88.75 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.551 HD21 ' O ' ' A' 1024 ' ' ALA . 4.1 mm? -77.54 -50.39 12.69 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.51 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.784 ' HA ' HG11 ' A' ' 955' ' ' VAL . 15.6 tt -57.0 -21.03 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 121.696 0.76 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.775 ' HB3' ' O ' ' A' ' 996' ' ' ALA . 0.6 OUTLIER -109.44 -22.19 12.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.578 -173.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.71 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 9.0 tptm -84.48 -36.45 22.26 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 123.126 0.266 . . . . 0.0 111.029 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 0.3 OUTLIER -78.69 -36.07 44.13 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.2 ttpt -58.73 -37.59 76.5 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 167.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.707 ' HB2' ' O ' ' A' 1000 ' ' ASN . 8.4 tt -68.85 -50.13 52.49 Favored 'General case' 0 C--O 1.214 -0.776 0 O-C-N 123.774 0.671 . . . . 0.0 110.295 -176.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' 1017 ' ' TYR . . . -55.55 -46.39 77.13 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.804 0.811 . . . . 0.0 109.959 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.966 HE21 ' HB3' ' A' ' 948' ' ' PRO . 0.9 OUTLIER -76.19 -13.54 60.18 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.777 -178.707 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -95.96 -40.42 9.29 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.412 0.625 . . . . 0.0 111.593 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 51.3 t80 . . . . . 0 C--N 1.315 -0.905 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.803 -176.436 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.555 ' NE2' ' HB1' ' A' 1005 ' ' ALA . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.104 0 CA-C-O 120.813 0.34 . . . . 0.0 110.521 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -59.17 -25.79 64.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.004 -172.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -54.52 -58.5 7.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.35 0.595 . . . . 0.0 109.847 173.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.604 ' HB2' ' HA ' ' A' 1005 ' ' ALA . 0.1 OUTLIER -55.0 -33.14 62.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.539 177.759 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 58.2 tttm -71.38 -45.47 62.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.904 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.62 -27.97 64.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.857 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.91 -44.08 94.49 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 170.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' A' 1002 ' ' MET . 1.7 tmt? -61.82 -42.08 98.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.581 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.91 -39.04 76.97 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.162 0.506 . . . . 0.0 110.784 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 31.4 m -69.57 -46.74 65.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.149 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.551 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -60.67 -36.09 77.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.543 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.488 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -59.04 -35.8 73.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.086 0.47 . . . . 0.0 110.754 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.587 ' O ' HG23 ' A' 1030 ' ' VAL . 16.2 t-160 -67.31 -31.7 72.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.78 177.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.501 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -72.35 -55.74 6.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.062 -178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 995' ' ' LEU . 24.5 tp -58.74 -35.85 73.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.046 0.451 . . . . 0.0 111.531 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.41 -36.93 66.99 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.879 0.371 . . . . 0.0 111.548 170.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' 1026 ' ' HIS . 82.6 t -64.14 -36.18 76.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 175.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.603 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 11.0 m-20 -60.59 -44.56 96.11 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.982 0.42 . . . . 0.0 110.486 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.538 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -59.52 -54.0 51.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.514 174.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -53.37 -38.29 63.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' 1038 ' ' VAL . 54.0 t30 -71.58 -54.02 11.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.186 -178.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.852 HD22 HD11 ' A' ' 991' ' ' LEU . 15.0 tp -57.52 -33.19 67.81 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.885 179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.581 ' N ' HG11 ' A' ' 929' ' ' VAL . 38.7 tp -52.62 -47.29 67.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.857 0.837 . . . . 0.0 109.842 176.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.3 t70 -68.51 -42.15 78.94 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.355 174.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.038 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.0 t -52.97 -61.91 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.459 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.781 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.887 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -82.45 -30.2 9.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.777 ' H ' HD12 ' A' 1039 ' ' ILE . 44.1 t0 -56.88 -37.49 71.45 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 165.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' 1045 ' ' LYS . 2.7 mp0 -73.15 -36.56 66.68 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 114.536 -1.211 . . . . 0.0 109.63 172.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.664 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.49 -52.44 59.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.24 0.543 . . . . 0.0 111.232 176.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.936 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 0.3 OUTLIER -58.83 -31.0 68.08 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.94 179.198 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.651 HD12 ' HB3' ' A' ' 920' ' ' ARG . 11.1 mp -77.88 -31.85 51.59 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.943 -0.117 . . . . 0.0 111.22 171.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.832 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 32.9 mmtp -59.87 -36.93 77.94 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.812 0.815 . . . . 0.0 108.915 175.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 42.2 ttp -69.22 -36.81 77.61 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.473 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' 1043 ' ' ARG . 48.6 mm -64.69 -42.45 95.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.539 172.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 37.3 m -55.98 -46.61 78.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.841 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . 0.631 ' OE1' ' HA ' ' A' ' 978' ' ' ALA . 24.9 tt0 . . . . . 0 N--CA 1.461 0.118 0 CA-C-O 120.575 0.226 . . . . 0.0 111.581 -178.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.978 ' HG3' ' HB2' ' A' 1043 ' ' ARG . 3.4 mmp_? . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 32.4 t 63.19 16.52 9.46 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -166.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 923' ' ' ASP . 1.3 m120 55.65 72.33 0.49 Allowed 'General case' 0 CA--C 1.498 -1.047 0 CA-C-N 114.326 -1.307 . . . . 0.0 109.602 -174.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -46.63 -174.75 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.532 0 O-C-N 126.299 2.249 . . . . 0.0 113.074 -168.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.601 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 3.1 tmtm? -46.9 -8.05 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.731 0.812 . . . . 0.0 112.307 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.735 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 0.0 OUTLIER -72.26 -49.76 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 C-N-CA 122.704 0.402 . . . . 0.0 110.896 174.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 14.9 t80 -73.3 -25.81 60.81 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.111 0.958 . . . . 0.0 108.416 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 930' ' ' THR . 97.1 mt-10 -73.54 -57.4 4.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.333 -177.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -66.49 -32.79 74.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.491 -171.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 1.079 HG11 ' HA ' ' A' 1036 ' ' LEU . 12.2 p -67.38 -40.97 85.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.789 177.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.59 HG22 ' HD2' ' A' ' 934' ' ' LYS . 59.6 m -53.8 -31.99 51.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.821 0.343 . . . . 0.0 110.694 166.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . 0.508 ' HA2' ' HB2' ' A' ' 934' ' ' LYS . . . -66.99 -31.97 79.52 Favored Glycine 0 C--O 1.227 -0.307 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 176.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 1.033 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.57 -51.06 70.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 173.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.5 t -60.87 -31.37 49.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.275 0.56 . . . . 0.0 110.906 174.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 930' ' ' THR . 0.0 OUTLIER -72.13 -43.53 64.55 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.008 -178.572 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 1.025 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.83 -25.26 56.11 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 122.201 -0.312 . . . . 0.0 111.349 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.623 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -75.87 -13.05 14.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 119.636 -0.825 . . . . 0.0 109.644 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 37.4 mm -71.11 -31.04 43.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 168.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 12.2 mm-40 -57.88 -40.71 80.88 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 171.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.467 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 47.6 ttp -56.47 -45.22 81.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.572 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.48 ' O ' HG22 ' A' ' 943' ' ' ILE . 16.2 p -73.19 -31.54 64.27 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.626 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 8.0 p -78.5 -40.8 34.23 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -177.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.503 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 4.4 mmtp -52.37 -47.16 66.34 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.47 174.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.603 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 16.5 tt -70.67 -22.35 23.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.522 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.828 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 32.9 mm-40 -55.68 -61.98 5.33 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.579 178.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 12.2 Cg_endo -92.92 -31.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.833 1.689 . . . . 0.0 114.086 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -83.82 150.41 58.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.218 0.532 . . . . 0.0 112.371 -169.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.587 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 72.6 Cg_endo -83.87 -177.83 3.28 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.371 2.714 . . . . 0.0 113.156 -177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.587 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 4.8 Cg_endo -49.3 -36.57 38.14 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 124.245 3.297 . . . . 0.0 113.96 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -55.06 -20.17 8.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.664 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.626 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 61.4 mm-40 -107.71 -4.96 17.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.591 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.9 m-30 -57.61 -42.19 82.75 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.49 -46.87 3.3 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 119.181 -1.007 . . . . 0.0 112.531 177.347 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 78.2 Cg_exo -57.49 -29.45 84.78 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.562 1.508 . . . . 0.0 114.676 171.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.603 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 19.6 ptp -73.81 -31.88 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.446 0.641 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -72.29 -25.6 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.325 174.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 17.9 tppt? -58.57 -41.68 86.22 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.99 -45.82 68.01 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.884 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -66.69 -29.71 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.022 178.119 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.545 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -67.4 -41.69 90.57 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.91 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.72 -40.6 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 109.901 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 1.033 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -48.45 -57.48 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 173.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.756 ' HB2' HD13 ' A' ' 995' ' ' LEU . 5.2 tt -70.52 -28.9 65.3 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 119.162 -1.015 . . . . 0.0 111.651 177.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -56.8 -57.24 13.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.701 0.286 . . . . 0.0 110.746 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 1.7 p -58.57 -44.55 89.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.18 0.514 . . . . 0.0 110.365 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 57.1 tp -51.1 -41.58 60.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.133 175.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 73.8 mt -54.82 -36.52 65.07 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.93 93.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.972 0.415 . . . . 0.0 109.978 175.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.684 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -63.85 -38.94 92.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.016 173.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 82.0 t -54.79 -31.9 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 O-C-N 122.235 -0.291 . . . . 0.0 110.802 172.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.509 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 2.7 m-20 -73.03 -22.48 60.63 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.757 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.5 mm-40 -74.23 -44.35 53.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.176 0.988 . . . . 0.0 108.638 171.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.503 ' OG ' HG21 ' A' ' 980' ' ' THR . 32.8 t -69.2 -24.13 63.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.892 177.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.719 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 55.7 tp -59.91 -50.68 85.33 Favored Pre-proline 0 C--O 1.218 -0.58 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.505 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 11.5 Cg_endo -61.12 -26.17 82.22 Favored 'Trans proline' 0 C--N 1.355 0.908 0 CA-C-N 121.424 1.544 . . . . 0.0 110.927 170.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.9 t -77.15 -11.08 13.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.222 174.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 1.9 tt -69.16 -53.23 14.07 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.62 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.462 ' N ' HD23 ' A' ' 976' ' ' LEU . 45.0 Cg_endo -69.44 -19.46 37.61 Favored 'Trans proline' 0 C--N 1.358 1.048 0 CA-C-N 120.457 1.199 . . . . 0.0 110.933 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -67.97 -55.31 13.2 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.694 172.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.703 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 31.1 m -166.11 -35.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -175.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.789 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.4 m -64.17 -18.43 64.47 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -168.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.772 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 11.6 t-160 -48.81 -26.43 2.39 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -172.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -72.2 -56.1 6.12 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.383 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.743 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.11 -42.65 62.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.789 ' HB ' HG22 ' A' ' 980' ' ' THR . 12.0 tt -58.76 -30.94 43.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.195 -174.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -72.68 -37.73 67.8 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.285 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.609 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 13.6 ptp -67.23 -59.06 3.74 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.629 -176.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.825 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -68.41 -45.57 72.28 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 1.128 ' HA ' HD12 ' A' ' 991' ' ' LEU . 6.1 tt0 -58.23 -44.32 88.19 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.616 -175.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -61.6 -33.88 74.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.424 0.63 . . . . 0.0 109.933 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.65 -42.55 61.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.469 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.128 HD12 ' HA ' ' A' ' 988' ' ' GLN . 14.5 mt -53.43 -58.13 8.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 174.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -45.65 -48.15 14.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.184 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 4.5 p -73.06 -47.62 43.07 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.011 -176.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.482 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.1 m-20 -82.09 -38.67 24.51 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -170.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -56.26 -60.21 3.83 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.623 0.647 . . . . 0.0 109.798 170.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.45 -23.46 38.96 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.899 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 993' ' ' SER . 20.5 tt0 -70.56 -43.24 69.89 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.297 -0.961 . . . . 0.0 108.554 177.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.634 ' HA ' ' HB1' ' A' 1024 ' ' ALA . 0.3 OUTLIER -60.84 -47.54 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.628 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.7 mt -55.63 -68.55 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.381 -179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.824 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -54.05 -18.91 4.06 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 114.395 -1.275 . . . . 0.0 113.108 177.897 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.64 ' HG3' ' HB2' ' A' 1024 ' ' ALA . 24.6 mmtp -85.26 -37.69 19.74 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.873 0.761 . . . . 0.0 111.395 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 998' ' ' LEU . 57.2 mtp -79.18 -34.78 42.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.652 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.9 tttm -63.54 -40.94 98.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 113.568 -1.651 . . . . 0.0 108.699 170.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.824 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.3 tp -60.77 -46.82 88.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.041 173.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -58.97 -45.18 91.18 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.6 0.714 . . . . 0.0 109.989 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -77.12 -6.58 53.42 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.261 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp-100 -91.09 -22.46 20.71 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.319 175.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 64.6 t80 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.48 -176.777 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.842 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.298 0 CA-C-O 120.713 0.292 . . . . 0.0 110.698 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.542 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 9.5 tt0 -53.59 -36.08 61.56 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.37 -59.3 4.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.116 0.484 . . . . 0.0 111.44 175.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.687 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.1 m-30 -62.27 -35.74 79.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.858 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.842 ' HB2' HE22 ' A' 1014 ' ' GLN . 86.2 tttt -55.63 -39.35 70.7 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.575 172.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.431 ' HD2' HD12 ' A' 1022 ' ' LEU . 26.5 tptp -68.29 -44.19 76.01 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -57.73 -33.08 68.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.96 174.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.737 ' HG2' ' O ' ' A' 1018 ' ' LYS . 9.0 ptt? -75.34 -25.66 57.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' 1018 ' ' LYS . 94.1 mt -71.15 -38.07 72.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.009 0.433 . . . . 0.0 109.857 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 98.9 m -59.76 -41.39 90.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.994 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.64 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -64.79 -38.39 90.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.159 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -62.6 -38.62 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.457 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.538 ' O ' HG23 ' A' 1030 ' ' VAL . 4.6 t-160 -68.78 -39.38 80.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.47 174.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.482 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -63.77 -51.64 63.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.782 -177.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.2 OUTLIER -60.79 -43.87 97.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.868 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.536 ' N ' HD23 ' A' 1028 ' ' LEU . . . -53.6 -28.3 31.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.819 173.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 1026 ' ' HIS . 88.5 t -72.4 -45.71 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 121.221 -0.192 . . . . 0.0 110.736 174.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.769 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.3 p30 -64.49 -47.27 79.58 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.632 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' 1036 ' ' LEU . . . -52.96 -29.08 26.82 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' 1036 ' ' LEU . 35.7 ttpt -83.49 -48.77 9.94 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.451 0.644 . . . . 0.0 109.308 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.539 ' O ' HG23 ' A' 1038 ' ' VAL . 2.2 t30 -61.54 -47.97 83.13 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.349 -176.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.864 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 12.6 tp -67.75 -33.22 74.42 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.798 -177.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 1.079 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -58.28 -27.43 64.03 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.543 0.687 . . . . 0.0 109.66 177.535 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.0 t0 -92.09 -34.49 14.35 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.636 -1.165 . . . . 0.0 108.694 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.864 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 21.7 t -63.62 -53.32 46.42 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 CA-C-N 115.423 -0.808 . . . . 0.0 113.108 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.794 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.1 pt -82.01 -30.49 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 122.432 -0.168 . . . . 0.0 111.228 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.913 ' O ' ' HD3' ' A' 1043 ' ' ARG . 19.9 t0 -53.78 -29.78 41.75 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 118.532 -1.267 . . . . 0.0 110.662 157.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' 1037 ' ' ASP . 58.9 mt-30 -81.46 -28.73 34.01 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 120.372 -1.455 . . . . 0.0 109.742 169.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.18 -52.94 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.823 0.344 . . . . 0.0 110.843 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.978 ' HB2' ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -62.34 -33.14 74.12 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 177.118 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.512 ' O ' ' HB ' ' A' 1047 ' ' ILE . 3.7 tp -79.08 -22.4 45.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.53 -0.731 . . . . 0.0 110.493 175.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.703 ' HG3' ' HB3' ' A' ' 979' ' ' SER . 13.7 mptt -62.75 -37.0 84.86 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 166.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.434 ' HB3' ' O ' ' A' 1043 ' ' ARG . 22.9 ttt -67.96 -36.11 79.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.373 174.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' A' 1044 ' ' LEU . 27.9 mm -60.65 -43.98 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.91 172.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.591 ' HB3' ' O ' ' A' 1045 ' ' LYS . 35.9 t -47.75 -38.06 14.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.492 174.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 . . . . . 0 C--N 1.328 -0.33 0 CA-C-O 120.629 0.252 . . . . 0.0 111.295 178.609 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.93 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 7.4 tpt180 . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 8.1 p -80.45 39.22 0.45 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -176.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.698 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.4 OUTLIER 47.93 56.81 6.73 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.047 0.939 . . . . 0.0 112.339 172.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 925' ' ' VAL . 5.0 p-10 -47.24 -171.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 O-C-N 125.946 2.029 . . . . 0.0 113.632 -175.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.615 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.3 tmtp? -42.04 -8.54 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.568 1.147 . . . . 0.0 113.403 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 1.04 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 2.7 m -73.4 -53.81 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 O-C-N 122.078 -0.389 . . . . 0.0 110.9 174.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.522 ' HD1' ' HB2' ' A' 1040 ' ' ASP . 62.3 t80 -76.69 -28.81 56.05 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.055 0.931 . . . . 0.0 108.829 -172.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 930' ' ' THR . 5.3 mm-40 -74.91 -52.27 11.67 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.522 -177.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.615 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 58.1 t30 -73.35 -31.04 63.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -173.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.971 HG11 HD11 ' A' 1039 ' ' ILE . 11.5 p -65.03 -42.22 94.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.596 175.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.675 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 73.6 m -52.0 -30.48 25.38 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-O 120.718 0.294 . . . . 0.0 110.495 166.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -60.83 -31.61 76.47 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.196 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.868 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.3 tt -66.92 -41.76 86.53 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 937' ' ' ILE . 40.1 t -63.89 -32.99 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.203 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -73.84 -31.18 63.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.37 0.605 . . . . 0.0 109.434 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.59 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -77.98 -30.39 50.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.141 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 933' ' ' VAL . 11.5 p -79.15 -12.73 13.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 175.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -70.1 -38.73 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 165.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.525 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 43.5 mt-10 -61.26 -44.86 96.56 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.416 172.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.586 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 25.2 ttt -56.88 -45.56 82.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.703 176.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 13.7 t -66.45 -34.03 77.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.61 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.657 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 47.6 m -76.46 -28.59 56.59 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.081 0.943 . . . . 0.0 109.245 -177.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.577 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 20.4 mmtm -69.7 -62.31 1.43 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.222 176.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.829 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -59.62 -31.78 47.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.401 -167.689 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.731 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 50.6 mt-30 -73.89 -64.24 0.78 Allowed Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.337 -175.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.8 Cg_endo -90.29 14.73 2.01 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.151 1.234 . . . . 0.0 114.675 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -127.51 153.61 77.43 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 121.875 -0.516 . . . . 0.0 111.164 175.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.511 ' HB2' ' OE1' ' A' ' 949' ' ' GLU . 4.2 Cg_exo -81.02 176.22 9.12 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.637 2.891 . . . . 0.0 112.629 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.709 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 81.6 Cg_exo -50.97 -32.26 37.6 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.755 2.97 . . . . 0.0 114.792 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.511 ' OE1' ' HB2' ' A' ' 947' ' ' PRO . 1.8 pm0 -55.65 -32.17 62.98 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.904 175.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.592 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER -91.97 -1.91 57.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 176.549 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.749 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.6 m-30 -65.83 -32.89 74.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.992 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.17 -51.61 2.67 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 119.129 -1.028 . . . . 0.0 112.046 173.204 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.992 ' HD3' HG13 ' A' ' 952' ' ' VAL . 81.1 Cg_exo -52.99 -30.3 48.17 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.167 1.911 . . . . 0.0 114.897 170.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.829 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.2 ptt? -65.25 -42.29 93.46 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.633 0.73 . . . . 0.0 109.739 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.573 ' HB ' ' HB3' ' A' 1002 ' ' MET . 79.0 t -73.62 -26.3 21.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.913 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.6 OUTLIER -53.32 -45.75 69.15 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.872 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.8 mm-40 -55.13 -48.59 73.45 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.981 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 4.1 m -74.01 -28.34 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.494 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.49 -43.53 44.56 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.646 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.458 HD23 ' HD3' ' A' ' 956' ' ' LYS . 4.3 mm? -62.33 -38.74 90.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.185 -0.508 . . . . 0.0 109.674 172.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.868 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -50.18 -55.85 13.46 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 171.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 2.4 tm? -66.43 -34.86 78.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.111 0.414 . . . . 0.0 110.621 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -56.84 -53.35 58.91 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 122.109 -0.369 . . . . 0.0 111.254 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.442 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 26.3 m -64.35 -40.15 95.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.301 0.572 . . . . 0.0 110.126 177.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 23.5 tp -53.11 -39.69 63.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.562 172.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.81 -27.7 63.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -65.11 -42.49 93.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 171.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.629 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.3 m -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.729 171.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -54.49 -30.62 21.89 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.446 174.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.642 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 29.5 t70 -75.89 -26.87 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.512 0.196 . . . . 0.0 111.161 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.4 mm-40 -70.77 -48.65 53.21 Favored 'General case' 0 C--O 1.247 0.921 0 CA-C-O 122.707 1.242 . . . . 0.0 107.943 173.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.541 ' OG ' HG21 ' A' ' 980' ' ' THR . 35.3 t -69.58 -22.98 63.48 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 114.361 -1.291 . . . . 0.0 110.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 1.087 ' HA ' HD13 ' A' ' 976' ' ' LEU . 1.7 tm? -54.43 -55.29 38.98 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.593 -177.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.642 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.3 Cg_endo -58.05 -26.8 77.01 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 120.749 1.303 . . . . 0.0 110.682 170.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.0 -16.28 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.62 175.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 1.087 HD13 ' HA ' ' A' ' 973' ' ' LEU . 10.8 mp -58.87 -61.37 7.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-O 118.983 -0.532 . . . . 0.0 110.553 173.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.628 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 50.5 Cg_exo -57.05 -31.31 89.82 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 121.68 1.587 . . . . 0.0 111.539 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' 1049 ' ' GLN . . . -61.02 -54.78 40.7 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.77 174.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.818 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -171.11 -37.8 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -176.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.653 HG22 ' HB ' ' A' ' 984' ' ' ILE . 25.2 m -59.27 -22.09 60.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -170.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.589 ' HA ' HG22 ' A' ' 984' ' ' ILE . 0.9 OUTLIER -52.66 -20.48 3.12 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -173.085 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -70.51 -55.94 7.75 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.738 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.04 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -75.23 -42.87 54.37 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.98 HD13 HD11 ' A' ' 976' ' ' LEU . 18.6 tt -60.85 -36.4 71.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 119.025 -1.07 . . . . 0.0 109.047 -173.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -59.42 -40.63 87.32 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.969 -0.693 . . . . 0.0 111.488 171.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.613 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 8.1 ptp -68.07 -63.25 1.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.588 -177.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.741 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.12 -33.47 50.48 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 24.4 tm0? -71.51 -41.43 69.24 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.383 0.992 . . . . 0.0 110.0 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -71.14 -23.03 62.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.625 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.3 tp -70.11 -48.79 56.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.092 175.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 79.7 mt -53.6 -43.29 68.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.013 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -50.57 -39.13 48.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.539 173.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 35.8 t -77.34 -50.32 13.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.443 ' CG ' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p30 -72.59 -39.66 67.18 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -174.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.494 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.0 tm? -56.88 -48.15 78.84 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 171.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.781 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -52.12 -26.48 11.35 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 171.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 5.2 mm-40 -79.08 -34.91 43.21 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.525 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.875 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 10.3 mp -80.22 -32.09 38.51 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.857 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.781 HG12 ' HA ' ' A' ' 996' ' ' ALA . 44.3 pt -68.94 -20.42 24.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.779 175.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 1.6 p30 -95.99 -17.37 21.05 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.875 ' HB3' ' HA ' ' A' ' 998' ' ' LEU . 37.2 tptt -65.86 -40.77 91.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.152 0.501 . . . . 0.0 109.906 168.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.964 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.0 ptt? -78.29 -34.42 48.82 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.869 ' O ' ' HB2' ' A' 1007 ' ' GLN . 27.1 tttp -61.42 -56.81 16.1 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.044 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' 1004 ' ' LEU . 14.0 mt -66.4 -48.32 70.48 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.884 -172.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.77 -47.91 84.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.41 0.624 . . . . 0.0 110.481 -178.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.44 59.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.528 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.869 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.9 tp-100 -80.78 -43.14 20.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.3 0.571 . . . . 0.0 110.062 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.639 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 14.5 m-85 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.375 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.709 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.577 ' N ' HE21 ' A' 1015 ' ' GLN . 0.0 OUTLIER -53.78 -34.71 59.94 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.138 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' 1017 ' ' TYR . 0.4 OUTLIER -49.49 -59.56 3.64 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.52 1.152 . . . . 0.0 110.236 171.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HD2' ' A' 1008 ' ' TYR . 86.8 m-85 -69.04 -29.95 68.21 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.031 -1.895 . . . . 0.0 110.928 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.709 ' HB2' HE22 ' A' 1014 ' ' GLN . 81.4 tttt -58.15 -46.91 84.86 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.253 165.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -76.72 -59.59 2.71 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.046 0.451 . . . . 0.0 112.058 -172.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -57.81 -46.31 84.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.19 -176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.705 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 20.4 mmt -74.73 -17.66 60.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.344 -177.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' 1018 ' ' LYS . 34.6 tp -70.92 -30.87 67.32 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 22.4 m -65.39 -38.66 90.67 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.664 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -67.35 -36.62 81.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.351 174.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.758 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -63.9 -34.84 78.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.869 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.459 ' O ' HG23 ' A' 1030 ' ' VAL . 40.2 t-80 -68.47 -31.32 70.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.719 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -61.28 -54.49 43.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 998' ' ' LEU . 0.3 OUTLIER -56.21 -48.35 76.6 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.049 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.53 ' N ' HD23 ' A' 1028 ' ' LEU . . . -54.2 -33.11 57.44 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.466 ' O ' ' HB3' ' A' 1033 ' ' LYS . 85.1 t -84.13 -38.61 14.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.994 0.426 . . . . 0.0 111.027 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.536 ' OD1' HD21 ' A' ' 990' ' ' LEU . 66.2 m-20 -72.7 -29.32 63.28 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.983 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.512 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -52.62 -55.2 24.07 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 161.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.653 ' O ' ' HB3' ' A' 1036 ' ' LEU . 5.0 tmmm? -52.31 -29.45 23.45 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 172.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' 1038 ' ' VAL . 60.5 t30 -68.13 -48.32 65.72 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.41 -0.806 . . . . 0.0 109.193 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.812 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 10.3 tp -64.18 -32.49 74.08 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.88 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.964 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.0 tm? -48.65 -32.15 7.82 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.88 0.872 . . . . 0.0 109.781 173.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' 1041 ' ' GLN . 22.3 t70 -92.74 -35.96 13.17 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.821 178.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.04 HG13 ' HB3' ' A' ' 983' ' ' GLU . 38.1 t -55.92 -62.21 0.9 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.215 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 1.04 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -75.94 -33.33 25.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.923 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.843 ' H ' HD12 ' A' 1039 ' ' ILE . 26.5 t70 -54.76 -31.37 58.55 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.47 162.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.821 ' HB3' ' HE2' ' A' 1045 ' ' LYS . 50.5 mt-30 -77.5 -33.76 54.32 Favored 'General case' 0 C--O 1.206 -1.232 0 C-N-CA 118.964 -1.094 . . . . 0.0 108.25 171.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.634 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.86 -53.07 60.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.571 0.544 . . . . 0.0 110.679 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.93 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.76 -42.79 17.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.404 172.072 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.486 ' N ' ' HD3' ' A' 1043 ' ' ARG . 60.3 tp -79.4 -28.94 41.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.644 0.259 . . . . 0.0 111.398 177.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.821 ' HE2' ' HB3' ' A' 1041 ' ' GLN . 73.0 mmtt -60.31 -43.85 95.97 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.859 0.838 . . . . 0.0 109.267 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 18.8 ttt -62.99 -36.33 83.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.347 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.875 HD11 ' HB2' ' A' ' 920' ' ' ARG . 39.3 mm -62.15 -49.96 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.509 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 39.1 t -52.35 -40.05 61.48 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.631 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . 0.412 ' HB2' ' HB1' ' A' ' 978' ' ' ALA . 48.7 tp60 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.421 0.629 . . . . 0.0 111.373 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 16.8 p -112.25 19.35 17.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.097 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.45 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.44 53.97 11.98 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.505 -174.227 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.62 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 29.8 t70 -47.33 -175.31 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 O-C-N 125.834 1.959 . . . . 0.0 112.268 -173.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.467 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.6 tmtp? -35.51 -24.09 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 124.294 1.038 . . . . 0.0 112.024 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.821 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.1 m -59.23 -52.41 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.297 175.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -76.96 -21.27 55.01 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 122.122 0.963 . . . . 0.0 108.975 -177.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 35.7 mt-10 -79.31 -54.59 5.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.087 -174.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.425 ' OD1' ' HE2' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.63 -32.54 68.08 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.812 -177.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 1.003 HG11 ' HA ' ' A' 1036 ' ' LEU . 9.8 p -63.71 -38.34 82.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.476 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.547 ' CG2' HD12 ' A' 1036 ' ' LEU . 7.7 p -70.17 -28.3 65.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.4 -30.59 65.01 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.335 171.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.997 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.2 tt -68.08 -48.73 64.74 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 937' ' ' ILE . 36.0 t -57.51 -44.63 85.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 110.343 174.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 0.0 OUTLIER -59.04 -32.18 69.52 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.043 176.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.7 -26.63 40.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.583 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.632 ' O ' ' HB3' ' A' ' 939' ' ' MET . 14.7 p -83.49 -12.56 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.035 171.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 933' ' ' VAL . 46.0 mm -73.83 -39.07 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 164.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.6 mm-40 -52.57 -33.8 47.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.314 169.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.97 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 32.5 ttm -60.03 -45.82 91.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.974 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.569 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 48.8 m -68.25 -30.05 69.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.173 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.697 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.6 m -76.49 -33.8 58.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.824 0.821 . . . . 0.0 109.008 -177.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.621 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 19.5 mmtt -60.09 -50.47 73.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.195 -1.366 . . . . 0.0 112.28 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.401 HD13 ' CE1' ' A' ' 951' ' ' TYR . 6.8 tp -69.67 -23.69 26.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.049 -176.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.733 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.9 mt-30 -52.68 -61.73 4.28 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.733 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 73.6 Cg_endo -99.62 10.0 0.72 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.783 1.656 . . . . 0.0 115.148 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.629 ' HB3' ' HG2' ' A' ' 950' ' ' GLU . . . -139.24 159.67 65.34 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 118.885 0.766 . . . . 0.0 112.844 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.7 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 1.5 Cg_endo -83.5 173.92 9.25 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.859 3.039 . . . . 0.0 111.569 174.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 91.4 Cg_exo -48.4 -16.29 0.66 Allowed 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 124.264 3.309 . . . . 0.0 115.277 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -54.43 -18.5 4.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.21 169.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.7 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.0 OUTLIER -95.4 -15.42 23.04 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.655 175.189 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 948' ' ' PRO . 5.8 m-30 -49.38 -44.14 44.69 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.566 0.698 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.125 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.1 OUTLIER -69.84 -56.66 7.31 Favored Pre-proline 0 CA--C 1.555 1.169 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.134 177.617 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.974 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.5 Cg_exo -55.71 -35.08 92.61 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.509 2.139 . . . . 0.0 114.964 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.97 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 24.6 ptt? -65.41 -42.18 92.83 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.798 -0.563 . . . . 0.0 110.091 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.676 HG13 ' HG ' ' A' ' 998' ' ' LEU . 74.7 t -67.41 -28.6 42.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.996 170.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.5 tmpt? -60.29 -40.15 89.44 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 33.5 mm-40 -54.37 -45.97 72.93 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.423 174.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 1.8 t -75.73 -29.6 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.19 -44.09 77.5 Favored Glycine 0 N--CA 1.455 -0.09 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.829 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.478 HD22 ' HE3' ' A' ' 956' ' ' LYS . 11.0 mp -64.52 -21.29 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 110.574 171.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.2 -53.05 59.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.565 177.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.698 ' HB3' HD22 ' A' ' 995' ' ' LEU . 2.7 tm? -72.51 -28.8 63.1 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.121 177.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.411 ' HB2' ' HA ' ' A' ' 960' ' ' LEU . 60.0 mtp180 -54.69 -59.59 4.51 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.756 -0.59 . . . . 0.0 111.717 170.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 17.2 p -55.87 -37.73 69.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.235 0.54 . . . . 0.0 110.559 175.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' 1035 ' ' LEU . 23.8 tp -65.85 -27.88 68.56 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.994 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 49.3 tp -64.71 -34.45 78.34 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.65 90.71 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.576 0.703 . . . . 0.0 109.714 173.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.821 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 4.1 m -66.97 -39.68 87.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.04 173.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.654 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 70.8 t -54.62 -37.24 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.497 174.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 35.0 t70 -71.8 -22.77 61.52 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 20.3 mm-40 -65.74 -52.93 47.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 123.187 1.47 . . . . 0.0 108.06 168.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.559 ' OG ' HG21 ' A' ' 980' ' ' THR . 42.3 t -66.06 -25.43 67.03 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.291 -1.777 . . . . 0.0 111.855 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 969' ' ' VAL . 53.7 mt -61.35 -51.01 80.88 Favored Pre-proline 0 C--O 1.214 -0.798 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.921 -177.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.564 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 57.2 Cg_exo -56.64 -30.05 82.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 121.567 1.595 . . . . 0.0 111.075 168.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 3.2 t -75.6 -13.36 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.827 176.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.668 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 4.9 tt -64.35 -55.47 30.36 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.564 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 51.9 Cg_exo -56.72 -32.26 90.52 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.61 1.54 . . . . 0.0 111.37 174.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.18 -65.05 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.012 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.1 m -157.99 -36.76 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.793 HG22 ' HB ' ' A' ' 984' ' ' ILE . 4.9 m -55.43 -18.48 7.04 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -174.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.668 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 16.1 p-80 -48.78 -20.19 0.45 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 79.7 mtt180 -78.11 -55.39 5.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.077 0.942 . . . . 0.0 110.154 175.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.853 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.71 -45.77 23.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.389 -175.023 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.793 ' HB ' HG22 ' A' ' 980' ' ' THR . 8.7 tp -56.78 -34.05 42.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.469 -172.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 0.0 OUTLIER -74.45 -34.5 63.19 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.165 179.279 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.0 ptp -60.75 -56.4 21.69 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 119.958 -0.697 . . . . 0.0 112.294 -174.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.575 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.62 -33.71 41.23 Favored 'General case' 0 C--O 1.209 -1.042 0 O-C-N 122.262 -0.274 . . . . 0.0 110.973 -176.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 1.092 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.6 tt0 -61.12 -46.09 92.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.099 0.475 . . . . 0.0 110.889 -176.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 989' ' ' LYS . 9.2 mmmm -62.6 -31.48 72.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.71 175.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.688 ' HG ' ' OD1' ' A' 1031 ' ' ASP . 5.7 tp -75.19 -32.9 61.35 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.653 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.092 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.2 mt -63.58 -48.44 77.39 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.199 0.523 . . . . 0.0 110.053 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -58.06 -38.27 75.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.451 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 4.6 t -60.75 -49.86 75.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.059 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.02 -27.82 10.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.678 -0.809 . . . . 0.0 113.103 -165.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.924 ' HA ' HD22 ' A' 1028 ' ' LEU . 5.7 tp -56.86 -48.03 79.06 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 167.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.412 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -58.09 -46.66 85.12 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.513 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.692 ' O ' ' HG2' ' A' 1001 ' ' LYS . 10.3 mm-40 -62.81 -36.65 83.87 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.241 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.676 ' HG ' HG13 ' A' ' 955' ' ' VAL . 47.0 tp -66.82 -33.4 75.53 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 995' ' ' LEU . 75.9 mt -61.53 -35.97 70.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.897 175.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.664 ' O ' ' HB2' ' A' 1004 ' ' LEU . 49.1 m-80 -89.22 -6.61 56.73 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.526 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 67.1 mmtt -86.58 -36.33 18.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 174.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.125 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -70.87 -38.12 73.09 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.458 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.799 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.0 tttm -60.37 -54.24 47.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.224 -1.353 . . . . 0.0 108.889 172.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.741 ' HG ' ' CD2' ' A' 1017 ' ' TYR . 14.9 tp -57.89 -48.22 80.49 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.53 90.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.336 0.589 . . . . 0.0 110.426 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -76.34 -12.12 60.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.565 0.697 . . . . 0.0 109.8 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.799 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -81.67 -28.08 33.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.07 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 56.6 t80 . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.63 -179.127 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.452 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.304 0 CA-C-O 121.047 0.451 . . . . 0.0 110.682 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.756 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.8 tt0 -56.13 -31.03 62.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.556 -171.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -51.35 -57.34 9.17 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.214 0.531 . . . . 0.0 110.531 171.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.741 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.0 m-30 -73.81 -23.52 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.703 178.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.756 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 62.2 tttp -64.43 -44.65 90.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.24 178.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' 1015 ' ' GLN . 97.3 mttt -59.53 -56.58 20.22 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.987 0.422 . . . . 0.0 109.946 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -50.89 -40.33 56.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.531 174.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.688 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 19.6 ttt -62.43 -52.21 64.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.4 tp -61.93 -35.24 77.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 40.1 m -63.76 -34.34 77.68 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.156 0.503 . . . . 0.0 110.811 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.687 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -79.7 -39.07 32.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.337 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -59.75 -43.85 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.144 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' 1030 ' ' VAL . 56.6 t60 -59.48 -36.24 75.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.379 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.4 65.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.924 HD22 ' HA ' ' A' ' 995' ' ' LEU . 5.0 tp -73.11 -32.0 64.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 178.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.95 -49.87 75.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.17 173.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' 1026 ' ' HIS . 99.2 t -69.17 -19.95 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 121.664 0.745 . . . . 0.0 110.622 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.811 ' OD2' ' HA ' ' A' ' 991' ' ' LEU . 0.6 OUTLIER -76.65 -43.79 36.67 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.031 177.25 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.626 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -57.13 -42.15 80.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -63.93 -33.94 76.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.975 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' 1038 ' ' VAL . 65.6 t30 -67.38 -43.69 80.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 991' ' ' LEU . 16.3 tp -75.7 -24.39 56.24 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 1.003 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -63.2 -32.67 74.12 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 120.876 0.369 . . . . 0.0 110.427 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.576 ' N ' HD23 ' A' 1036 ' ' LEU . 32.2 t70 -86.7 -36.9 18.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.853 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 25.4 t -52.82 -63.15 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.354 176.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.891 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.4 pt -81.54 -28.63 10.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.188 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -51.7 -48.41 63.55 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 163.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' 1045 ' ' LYS . 41.8 mt-30 -71.75 -25.94 62.25 Favored 'General case' 0 C--O 1.203 -1.35 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.224 177.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.628 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.7 -54.68 30.18 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 118.177 0.444 . . . . 0.0 110.969 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.62 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 2.0 mpt_? -55.35 -32.96 62.98 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.138 174.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.506 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 55.2 tp -72.61 -37.05 68.21 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.874 174.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 68.5 mmtt -58.88 -33.44 70.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.453 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 27.1 ttt -73.07 -37.16 66.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.576 -178.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' 1043 ' ' ARG . 51.4 mm -61.16 -45.77 97.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.2 t -56.47 -60.25 3.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.243 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 55.3 tp60 . . . . . 0 C--N 1.327 -0.41 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -174.796 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.635 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 36.0 m -86.91 26.45 1.14 Allowed 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.997 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.635 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.6 62.17 2.3 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.11 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.649 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 6.5 t0 -46.01 -176.17 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 125.733 1.895 . . . . 0.0 112.702 -173.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.8 tmtp? -36.59 -24.82 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 124.236 1.014 . . . . 0.0 111.914 177.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.883 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.1 m -58.63 -52.3 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.104 175.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 64.1 t80 -75.92 -24.66 55.56 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -176.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 31.1 mt-10 -70.51 -55.9 7.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.544 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.537 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 0.2 OUTLIER -73.77 -32.89 64.01 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.468 -176.586 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.961 HG11 ' HA ' ' A' 1036 ' ' LEU . 5.5 p -62.84 -35.83 72.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.294 176.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.669 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 6.5 p -72.43 -32.71 66.54 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.79 -31.28 67.47 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.35 172.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.649 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 2.8 tp -62.0 -46.79 87.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.551 ' O ' HG22 ' A' ' 936' ' ' VAL . 61.3 t -62.8 -37.78 80.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.907 0.384 . . . . 0.0 110.442 174.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.4 mmpt? -62.47 -31.97 72.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.388 0.613 . . . . 0.0 109.784 176.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.688 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -81.61 -24.6 36.31 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.561 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.744 ' O ' ' HG2' ' A' ' 939' ' ' MET . 1.6 m -79.61 -10.76 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 C-N-CA 119.211 -0.996 . . . . 0.0 109.358 172.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.531 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 67.0 mt -73.86 -30.54 28.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 167.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.6 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 7.5 mm-40 -55.21 -47.42 75.32 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.001 170.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.744 ' HG2' ' O ' ' A' ' 936' ' ' VAL . 11.5 ptt? -62.19 -40.6 96.6 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.283 0.364 . . . . 0.0 110.604 -175.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.5 p -68.9 -31.55 70.54 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.568 0.223 . . . . 0.0 111.27 -178.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.713 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.8 m -80.08 -42.75 23.05 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.5 tppp? -59.67 -39.34 84.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 113.268 -1.787 . . . . 0.0 111.479 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.785 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -73.64 -31.98 33.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 121.321 -0.152 . . . . 0.0 110.975 -179.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.1 mt-30 -49.91 -61.84 3.2 Favored Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.713 ' HD3' ' O ' ' A' ' 941' ' ' SER . 93.7 Cg_endo -99.12 16.1 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.09 1.86 . . . . 0.0 113.42 -172.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -116.39 151.84 47.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 5.4 Cg_exo -80.91 -179.63 5.26 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.766 2.978 . . . . 0.0 110.516 170.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 10.2 Cg_endo -53.41 -24.88 29.45 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.804 2.336 . . . . 0.0 113.063 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.461 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 36.3 mt-10 -57.17 -44.11 83.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.718 178.113 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.952 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.9 mp0 -94.03 1.09 56.27 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.569 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.628 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.6 m-85 -58.12 -45.56 87.07 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 170.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.089 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -72.33 -47.01 10.54 Favored Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 119.502 -0.879 . . . . 0.0 112.293 176.127 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.089 ' HD3' HG13 ' A' ' 952' ' ' VAL . 80.4 Cg_exo -51.47 -30.78 36.41 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 122.093 1.862 . . . . 0.0 115.108 171.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.785 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 2.4 ptt? -64.62 -46.02 84.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.95 -1.1 . . . . 0.0 108.653 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.673 ' N ' ' HG3' ' A' ' 954' ' ' MET . 0.3 OUTLIER -64.33 -25.06 37.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.777 173.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.4 ttmm -61.85 -37.59 85.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 176.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -59.35 -46.73 87.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.863 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 936' ' ' VAL . 9.0 m -65.5 -28.16 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.605 176.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.82 64.47 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.179 -1.01 . . . . 0.0 111.921 178.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.38 -36.63 71.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.95 0.405 . . . . 0.0 110.24 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.688 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -56.9 -56.04 26.73 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.792 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.532 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 30.6 tp -63.08 -35.5 80.47 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.649 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 52.1 mtm-85 -62.73 -48.95 77.02 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.272 176.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.508 HG22 ' OD1' ' A' ' 928' ' ' ASN . 5.5 m -56.08 -39.05 71.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.773 0.797 . . . . 0.0 109.792 172.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.592 HD22 HD22 ' A' ' 932' ' ' LEU . 64.8 tp -62.48 -27.66 69.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.974 176.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 86.1 mt -64.77 -28.94 69.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.331 178.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.84 -40.93 97.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.249 0.547 . . . . 0.0 109.713 172.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.755 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.5 m -61.46 -43.74 98.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.57 172.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.554 HG13 HD11 ' A' ' 984' ' ' ILE . 91.2 t -54.88 -31.42 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.157 177.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.9 t70 -75.78 -26.3 57.21 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.571 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 57.1 mm-40 -70.66 -49.15 50.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 122.709 1.242 . . . . 0.0 108.92 171.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.626 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.3 t -68.28 -24.69 64.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.67 -1.604 . . . . 0.0 111.649 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 3.8 tt -61.43 -51.45 77.38 Favored Pre-proline 0 C--O 1.218 -0.591 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.614 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.4 Cg_exo -59.82 -27.35 84.73 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 121.09 1.425 . . . . 0.0 111.214 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.7 t -78.24 -11.8 13.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.318 175.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.864 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.8 tt -65.64 -54.86 26.98 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.207 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.572 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 28.3 Cg_endo -64.84 -23.53 62.28 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.302 1.334 . . . . 0.0 111.186 174.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.94 -60.38 3.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.375 172.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.3 m -165.35 -34.43 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -177.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.827 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.0 m -55.83 -19.91 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -172.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.864 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 11.7 p-80 -49.74 -21.15 0.99 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.891 0.701 . . . . 0.0 112.891 -173.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -73.98 -52.96 11.14 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.672 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.035 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.75 -43.38 30.99 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.202 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.827 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -58.27 -34.75 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -173.316 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -73.81 -32.4 63.72 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.657 175.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.511 ' HE1' ' HG3' ' A' ' 983' ' ' GLU . 12.0 ptt? -69.14 -54.44 14.89 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.564 -175.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.679 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.08 -33.92 38.45 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 991' ' ' LEU . 53.3 tp60 -59.37 -46.42 88.69 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.258 0.481 . . . . 0.0 111.049 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -67.76 -25.69 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.505 0.669 . . . . 0.0 109.965 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 1.7 tp -73.25 -42.33 62.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.305 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.992 HD12 ' HA ' ' A' ' 988' ' ' GLN . 10.3 mt -58.57 -49.15 78.48 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 121.365 0.602 . . . . 0.0 109.897 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.452 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 10.2 t30 -55.73 -41.08 73.35 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.545 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.6 t -69.48 -43.09 73.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.61 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 35.7 m-20 -95.63 -41.0 9.12 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.195 -0.602 . . . . 0.0 112.383 -169.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.042 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.38 -53.13 61.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 175.317 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 992' ' ' ASN . . . -60.6 -48.58 81.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.439 -177.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.0 pt-20 -64.34 -32.02 73.45 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 118.949 -1.1 . . . . 0.0 111.414 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.725 HD23 HD13 ' A' 1028 ' ' LEU . 54.9 tp -64.48 -38.27 90.43 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.852 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.549 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 76.8 mt -55.59 -39.22 53.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.401 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.694 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 33.8 m-80 -95.49 -5.27 43.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.004 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 15.8 tptp -83.35 -44.39 14.91 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.477 ' SD ' ' HB3' ' A' ' 951' ' ' TYR . 40.0 tpp -78.51 -31.14 47.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.947 173.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.761 ' O ' ' HB2' ' A' 1007 ' ' GLN . 83.3 tttt -58.34 -49.21 77.99 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 171.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.33 -37.29 82.73 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.43 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -67.63 -44.8 77.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.381 0.61 . . . . 0.0 110.69 178.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.49 HE21 ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -74.26 -9.72 58.89 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.229 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.761 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.7 OUTLIER -91.53 -10.5 40.48 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.124 -0.943 . . . . 0.0 109.718 175.646 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 26.1 t80 . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.271 -177.308 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.596 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.053 0.454 . . . . 0.0 109.884 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.562 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 46.5 mt-30 -67.42 -30.68 70.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.779 -175.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.58 -47.44 57.95 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.675 169.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.6 m-30 -77.42 -24.71 50.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.776 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.596 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 83.9 tttt -72.44 -37.21 68.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.754 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -66.77 -50.81 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -46.86 -40.99 14.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.271 170.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.466 ' HB3' ' O ' ' A' 1018 ' ' LYS . 14.3 tmm? -61.46 -43.15 99.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.443 177.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.6 -42.0 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.755 0.312 . . . . 0.0 111.089 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 12.5 m -63.36 -36.4 83.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.064 0.459 . . . . 0.0 110.551 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.25 -36.23 47.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.814 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.638 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.1 -31.87 73.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.628 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 61.4 t60 -72.1 -46.38 56.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.109 176.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.79 85.97 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.088 0.471 . . . . 0.0 109.981 177.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.042 HD12 ' HA ' ' A' ' 995' ' ' LEU . 2.0 tt -58.74 -51.77 68.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.557 172.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.82 65.38 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.712 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 84.5 t -66.4 -33.81 65.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 174.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.671 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.1 p30 -71.89 -41.92 67.39 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -55.81 -50.37 70.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 0.0 110.025 171.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.556 ' O ' ' HB3' ' A' 1036 ' ' LEU . 13.3 tptm -66.5 -37.17 84.49 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.921 -1.036 . . . . 0.0 112.005 -174.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.571 ' O ' HG23 ' A' 1038 ' ' VAL . 60.4 t30 -75.71 -35.11 60.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.412 -174.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.761 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 7.0 tp -77.67 -30.04 51.8 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.961 ' HA ' HG11 ' A' ' 929' ' ' VAL . 6.4 tt -48.77 -41.67 33.16 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.698 0.761 . . . . 0.0 109.538 172.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -75.71 -46.74 29.47 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.205 174.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.035 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.7 t -48.02 -58.91 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.883 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.6 pp -83.44 -30.46 8.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.737 ' H ' HD12 ' A' 1039 ' ' ILE . 5.5 t0 -56.94 -42.48 80.14 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 165.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' A' 1045 ' ' LYS . 55.0 mt-30 -75.12 -23.62 57.93 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-N 114.332 -1.304 . . . . 0.0 110.837 174.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.64 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.38 -55.36 29.4 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 118.818 0.735 . . . . 0.0 110.721 171.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.649 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 0.9 OUTLIER -58.66 -27.67 64.98 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.703 173.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.557 ' O ' HD23 ' A' 1044 ' ' LEU . 5.8 tt -75.35 -32.87 61.0 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.018 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.836 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 74.1 mmtt -61.39 -30.28 70.45 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 175.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 24.5 ttt -77.23 -30.26 54.48 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.931 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.467 ' HB ' ' O ' ' A' 1044 ' ' LEU . 48.5 mm -65.36 -46.55 90.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 169.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 52.4 m -55.67 -37.54 68.43 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.972 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 48.4 tt0 . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.341 175.932 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 1.055 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 21.1 t -97.78 25.55 5.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.175 0.512 . . . . 0.0 109.728 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.11 62.33 2.72 Favored 'General case' 0 CA--C 1.498 -1.045 0 CA-C-O 122.129 0.966 . . . . 0.0 109.479 -176.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.512 ' O ' ' N ' ' A' ' 925' ' ' VAL . 29.4 m-20 -44.62 -171.6 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 110.77 -2.923 . . . . 0.0 113.547 -176.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.502 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 1.2 tmtm? -38.09 -17.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.883 0.873 . . . . 0.0 112.865 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 1.03 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 15.8 m -65.05 -52.97 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 O-C-N 122.155 -0.341 . . . . 0.0 111.719 177.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.526 ' N ' HG23 ' A' ' 925' ' ' VAL . 46.4 t80 -75.89 -22.3 56.27 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -174.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -74.52 -61.64 1.8 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.209 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.438 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -65.96 -31.79 72.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.806 -173.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.802 HG11 ' HA ' ' A' 1036 ' ' LEU . 11.0 p -65.25 -43.42 95.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.606 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 18.4 p -71.21 -25.17 62.4 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.77 -27.95 62.39 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.028 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.908 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.8 tt -65.56 -46.43 79.52 Favored 'General case' 0 CA--C 1.523 -0.065 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 172.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.1 t -58.71 -41.71 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.644 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.7 OUTLIER -65.49 -27.69 68.67 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.061 0.457 . . . . 0.0 110.972 177.596 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.599 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -81.28 -26.17 35.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.198 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.59 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -82.96 -12.49 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.638 0.733 . . . . 0.0 109.489 172.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 933' ' ' VAL . 49.4 mm -66.95 -34.6 71.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.8 mt-10 -62.18 -47.53 84.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.063 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.8 ttp -55.57 -39.74 71.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.19 176.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.627 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 13.3 t -61.93 -38.2 87.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.07 0.462 . . . . 0.0 110.546 178.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.566 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.0 m -78.24 -40.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.165 0.983 . . . . 0.0 108.597 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.697 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 5.9 tmtp? -67.86 -34.94 77.66 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.278 -177.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.561 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 0.0 OUTLIER -73.4 -28.4 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.281 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.68 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 74.5 mt-30 -49.7 -54.24 33.59 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.624 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.6 Cg_endo -99.63 21.43 0.26 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.94 1.76 . . . . 0.0 113.37 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -94.95 130.11 33.79 Favored Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -171.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 92.9 Cg_endo -85.31 -179.31 3.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.034 2.489 . . . . 0.0 108.94 158.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.745 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 73.5 Cg_exo -51.07 -33.7 44.21 Favored 'Trans proline' 0 C--O 1.241 0.647 0 C-N-CA 122.048 1.832 . . . . 0.0 112.089 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.549 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 5.0 mp0 -55.07 -42.24 72.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.244 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.64 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 29.7 mm-40 -94.86 -5.8 44.19 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.468 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.745 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 12.1 m-30 -59.82 -37.32 78.84 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.941 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -73.3 -53.47 4.71 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 120.282 -0.567 . . . . 0.0 112.054 176.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.941 ' HD3' HG13 ' A' ' 952' ' ' VAL . 63.6 Cg_exo -56.65 -31.57 87.78 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.033 1.822 . . . . 0.0 114.454 175.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 939' ' ' MET . 18.4 ptt? -68.42 -36.71 79.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.232 1.015 . . . . 0.0 109.592 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.969 HG11 ' HA ' ' A' ' 999' ' ' ILE . 84.3 t -71.87 -25.41 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.868 174.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.567 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 59.4 tttp -56.24 -39.51 72.67 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.75 -48.17 75.73 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.032 175.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.59 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.8 m -76.52 -22.82 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-O 120.944 0.402 . . . . 0.0 112.017 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.55 -42.17 64.11 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.675 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.25 -24.57 63.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.91 0.386 . . . . 0.0 110.004 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.0 -56.39 22.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.62 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.581 HD11 HD13 ' A' ' 991' ' ' LEU . 53.7 tp -72.4 -31.5 65.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.199 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.461 ' C ' ' HD3' ' A' ' 963' ' ' ARG . 3.3 tmt_? -61.54 -53.67 53.34 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.438 HG22 ' OD1' ' A' ' 928' ' ' ASN . 15.7 m -59.14 -32.34 69.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.301 0.572 . . . . 0.0 110.526 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 932' ' ' LEU . 0.5 OUTLIER -63.79 -41.67 97.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.937 177.254 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 96.6 mt -53.04 -31.22 40.22 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.317 174.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -49.61 74.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.415 0.626 . . . . 0.0 109.795 173.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.844 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -56.2 -46.23 79.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.629 170.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.474 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -53.36 -30.81 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.81 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 13.0 t70 -70.6 -33.1 70.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.325 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.8 mm-40 -60.49 -54.59 43.73 Favored 'General case' 0 C--O 1.247 0.946 0 CA-C-O 122.603 1.192 . . . . 0.0 108.46 171.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 40.0 t -55.61 -26.82 46.12 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 114.224 -1.353 . . . . 0.0 112.129 174.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 1.034 ' HA ' HD13 ' A' ' 976' ' ' LEU . 7.0 tt -57.99 -53.85 61.57 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-O 118.7 -0.666 . . . . 0.0 111.743 -174.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.644 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.8 Cg_exo -54.87 -26.99 51.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 CA-C-N 120.857 1.342 . . . . 0.0 111.25 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.737 HG13 ' HB2' ' A' 1046 ' ' MET . 3.8 t -78.3 -17.32 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 120.073 -0.651 . . . . 0.0 111.554 176.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 1.038 ' HG ' HG21 ' A' ' 984' ' ' ILE . 8.6 mp -56.86 -64.37 2.59 Favored Pre-proline 0 N--CA 1.471 0.616 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.36 173.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.724 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 15.2 Cg_endo -57.67 -30.33 88.5 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.625 1.55 . . . . 0.0 111.826 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -58.17 -57.39 13.08 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.355 174.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 1.063 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 59.9 m -163.3 -47.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.118 0.485 . . . . 0.0 111.463 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.726 HG22 ' HB ' ' A' ' 984' ' ' ILE . 23.8 m -48.54 -24.12 1.21 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 984' ' ' ILE . 49.8 p-80 -50.06 -32.51 15.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -66.71 -52.86 39.65 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 119.455 1.025 . . . . 0.0 111.968 176.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.744 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.2 OUTLIER -70.71 -45.54 64.76 Favored 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.338 -179.23 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 1.038 HG21 ' HG ' ' A' ' 976' ' ' LEU . 8.8 tp -57.68 -39.38 69.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.609 -175.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 11.7 pt-20 -69.98 -27.28 64.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.014 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.587 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 5.4 ptp -71.97 -46.74 56.26 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.801 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.908 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -72.48 -47.09 51.52 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.847 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.871 ' HA ' HD12 ' A' ' 991' ' ' LEU . 27.2 tt0 -57.59 -45.69 84.95 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -175.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -65.22 -35.08 79.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.441 0.639 . . . . 0.0 109.315 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.77 -35.6 78.99 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.682 177.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 988' ' ' GLN . 15.6 mt -61.3 -57.47 12.2 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.316 0.579 . . . . 0.0 109.671 175.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -45.8 -43.0 12.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.053 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 17.1 p -76.26 -46.55 27.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -178.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.538 ' HB2' ' HB3' ' A' 1031 ' ' ASP . 1.0 OUTLIER -82.65 -37.32 25.05 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -169.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.704 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -58.61 -47.0 85.83 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 168.443 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.826 ' HA ' HG22 ' A' ' 999' ' ' ILE . . . -52.7 -28.38 21.66 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 993' ' ' SER . 77.1 mt-10 -77.13 -34.08 56.67 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 118.575 -1.25 . . . . 0.0 108.693 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.666 HD23 HD13 ' A' 1028 ' ' LEU . 18.6 tp -78.23 -29.03 48.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.969 ' HA ' HG11 ' A' ' 955' ' ' VAL . 5.8 tt -77.21 -0.74 3.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-O 121.908 0.861 . . . . 0.0 108.827 172.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.695 ' HA ' ' HB2' ' A' 1003 ' ' LYS . 6.8 m-80 -102.78 -6.36 22.67 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.62 170.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 1.01 ' HD3' ' HB2' ' A' 1021 ' ' MET . 42.3 tptt -73.12 -36.8 66.78 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 162.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.745 ' HB2' ' HB ' ' A' ' 955' ' ' VAL . 24.2 ttm -64.77 -60.96 2.49 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.42 -1.264 . . . . 0.0 108.626 171.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.779 ' O ' ' HB2' ' A' 1007 ' ' GLN . 45.3 mttp -65.17 -57.11 9.38 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.241 -174.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.665 HD23 ' HB3' ' A' 1017 ' ' TYR . 8.4 tt -82.3 -31.31 30.06 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -163.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.532 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -71.33 -43.19 67.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.075 178.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.426 HE21 ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -76.79 -26.28 54.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.458 176.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.779 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.9 tp-100 -53.83 -52.96 58.68 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.828 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.629 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 28.1 m-85 . . . . . 0 C--N 1.321 -0.639 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.851 -175.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.736 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.415 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 2.6 mp0 -59.88 -22.41 62.31 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -53.99 -59.54 4.5 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 167.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.736 ' CD2' ' HA ' ' A' 1014 ' ' GLN . 0.3 OUTLIER -61.55 -20.43 63.25 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.725 ' O ' ' HB3' ' A' 1021 ' ' MET . 39.5 ttmt -79.35 -43.46 23.48 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.301 171.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -68.04 -41.88 81.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.397 0.618 . . . . 0.0 109.343 177.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.473 HE21 ' HB2' ' A' 1020 ' ' GLN . 7.0 tt0 -56.23 -31.46 63.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.696 173.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 1.01 ' HB2' ' HD3' ' A' 1001 ' ' LYS . 43.5 ttp -56.49 -44.73 80.93 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 173.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.69 -43.05 76.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.595 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.1 m -71.38 -46.57 59.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.714 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.94 76.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.713 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -64.26 -36.35 83.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 110.491 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.594 ' O ' HG23 ' A' 1030 ' ' VAL . 14.1 t-80 -66.94 -42.25 85.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.16 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.53 -47.54 85.09 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.477 0.485 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.9 OUTLIER -65.41 -42.26 92.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.588 0.709 . . . . 0.0 110.233 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.61 -28.95 61.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.907 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' 1026 ' ' HIS . 74.2 t -74.29 -47.69 39.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.122 177.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.704 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -59.74 -42.36 92.99 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.694 179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -62.83 -49.95 72.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.982 0.42 . . . . 0.0 110.436 175.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.731 ' HA ' HD23 ' A' 1036 ' ' LEU . 87.6 tttt -59.81 -38.51 82.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.706 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.533 ' O ' HG23 ' A' 1038 ' ' VAL . 9.1 t30 -72.4 -53.72 11.43 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.315 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 991' ' ' LEU . 29.0 tp -56.5 -33.96 66.5 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.141 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.802 ' HA ' HG11 ' A' ' 929' ' ' VAL . 1.8 pp -61.79 -38.67 88.92 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.809 0.731 . . . . 0.0 109.396 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.0 t70 -66.97 -40.07 87.36 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.181 174.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.908 HG21 ' HB2' ' A' ' 987' ' ' ALA . 76.7 t -60.87 -68.44 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.653 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 1.03 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -70.07 -33.75 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -173.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.74 ' H ' HD12 ' A' 1039 ' ' ILE . 6.9 t70 -48.81 -45.18 40.04 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 122.43 1.109 . . . . 0.0 108.372 166.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' A' 1045 ' ' LYS . 82.1 mm-40 -79.11 -24.84 43.13 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 113.487 -1.688 . . . . 0.0 111.134 177.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.01 -55.02 31.15 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.526 173.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 1.055 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 21.8 mmm180 -57.86 -32.97 68.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.829 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.634 HD12 ' HB ' ' A' 1047 ' ' ILE . 60.3 tp -77.99 -26.33 48.55 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 121.113 -0.235 . . . . 0.0 111.235 175.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 1.063 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 46.7 mmtm -57.08 -44.45 83.11 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.664 0.745 . . . . 0.0 109.536 171.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.737 ' HB2' HG13 ' A' ' 975' ' ' VAL . 26.9 ttt -65.62 -38.93 90.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.66 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.634 ' HB ' HD12 ' A' 1044 ' ' LEU . 49.7 mm -66.87 -35.81 75.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.894 175.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 36.9 t -60.55 -53.85 52.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.91 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 C--N 1.328 -0.356 0 CA-C-O 121.046 0.451 . . . . 0.0 110.911 -178.363 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.938 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 20.3 tpt180 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 67.5 m 71.27 105.37 0.06 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -160.32 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.687 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -53.53 85.44 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -166.884 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 922' ' ' ASN . 1.9 t70 -47.16 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 112.785 -2.007 . . . . 0.0 113.238 -174.307 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.9 tmtp? -41.82 -23.15 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.428 -178.534 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.823 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 1.9 m -56.41 -54.86 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 118.745 -0.645 . . . . 0.0 112.048 172.716 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.687 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 20.2 t80 -74.37 -34.91 63.5 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 118.843 -1.143 . . . . 0.0 107.934 -175.133 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 11.8 mm-40 -58.68 -57.27 13.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.113 -1.858 . . . . 0.0 112.877 -176.47 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.463 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 3.1 t-20 -73.72 -35.26 65.08 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.905 -171.554 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.774 HG22 ' CD2' ' A' ' 965' ' ' LEU . 3.8 t -61.69 -36.03 71.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.036 -0.666 . . . . 0.0 110.235 175.012 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.568 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 42.5 m -66.5 -37.75 85.74 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 171.942 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.36 -30.37 64.58 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.691 174.3 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.564 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.42 -39.38 90.56 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 173.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG13 ' A' ' 937' ' ' ILE . 48.0 t -66.14 -40.73 87.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.607 173.256 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.5 OUTLIER -61.73 -33.69 74.49 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 178.438 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -80.63 -26.56 37.65 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.33 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.567 ' O ' ' HG2' ' A' ' 939' ' ' MET . 9.5 p -78.19 -16.44 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 119.448 -0.901 . . . . 0.0 108.877 171.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.617 HG13 ' O ' ' A' ' 933' ' ' VAL . 51.4 mt -67.33 -38.13 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 167.112 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.676 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 64.9 mm-40 -52.52 -38.52 59.84 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.123 172.221 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.929 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.9 ptt? -61.63 -40.57 95.34 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 t -74.24 -31.05 62.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.378 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.676 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.1 t -71.57 -52.55 17.57 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.538 0.685 . . . . 0.0 110.095 -176.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.53 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -80.18 -11.03 59.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.03 -173.602 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.976 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -79.65 -26.97 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.748 0.785 . . . . 0.0 109.264 173.772 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.8 mt-30 -60.97 -51.77 76.98 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.83 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.676 ' HD3' ' O ' ' A' ' 941' ' ' SER . 85.5 Cg_endo -97.3 17.57 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.459 1.439 . . . . 0.0 114.992 -176.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -130.65 167.47 21.07 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.411 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 6.5 Cg_endo -90.52 170.02 3.81 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 124.031 3.154 . . . . 0.0 111.776 168.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.555 ' C ' ' H ' ' A' ' 950' ' ' GLU . 5.4 Cg_endo -47.06 -26.68 5.31 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 124.908 3.739 . . . . 0.0 115.023 -167.028 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 8.7 mm-40 -52.5 0.7 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.921 170.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.976 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -106.9 -25.17 11.77 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 109.74 -0.466 . . . . 0.0 109.74 179.31 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.493 ' O ' ' HG2' ' A' ' 954' ' ' MET . 21.6 m-85 -47.02 -42.34 18.07 Favored 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 173.27 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.024 HG13 ' HD3' ' A' ' 953' ' ' PRO 0.25 0.4 OUTLIER -73.89 -58.29 2.17 Favored Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 119.028 -1.069 . . . . 0.0 113.024 178.52 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.024 ' HD3' HG13 ' A' ' 952' ' ' VAL . 36.0 Cg_exo -64.4 -18.52 63.37 Favored 'Trans proline' 0 C--N 1.358 1.075 0 C-N-CA 121.92 1.747 . . . . 0.0 114.631 178.011 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.929 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 22.7 ptt? -70.8 -43.09 69.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 176.797 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.777 ' HB ' ' HB3' ' A' 1002 ' ' MET . 78.9 t -68.54 -27.64 37.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.664 172.329 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.4 tptm -52.32 -45.08 65.45 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 171.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' A' ' 954' ' ' MET . 4.7 mm-40 -56.34 -46.77 79.78 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.988 177.648 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.567 HG12 ' HA ' ' A' ' 955' ' ' VAL . 9.8 p -81.93 -22.18 9.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -178.546 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.651 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -70.46 -45.34 54.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.842 -1.17 . . . . 0.0 112.016 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.433 HD23 ' HD3' ' A' ' 963' ' ' ARG . 87.5 mt -65.92 -24.35 66.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.686 0.279 . . . . 0.0 110.443 170.642 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.8 -55.41 30.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.665 175.865 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.917 HD13 ' HB2' ' A' ' 995' ' ' LEU . 6.7 tt -66.4 -27.45 67.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.501 -0.479 . . . . 0.0 110.656 179.609 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.433 ' HD3' HD23 ' A' ' 960' ' ' LEU . 17.1 mtp180 -65.69 -48.07 73.27 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.961 -0.462 . . . . 0.0 111.287 171.037 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 22.1 m -55.99 -40.52 73.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.739 0.781 . . . . 0.0 109.68 171.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.774 ' CD2' HG22 ' A' ' 929' ' ' VAL . 1.3 tm? -59.32 -28.69 67.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.482 175.151 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 963' ' ' ARG . 0.4 OUTLIER -68.28 -25.08 64.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.993 178.982 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 971' ' ' GLU . . . -68.74 -36.96 79.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.101 171.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.779 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.1 m -64.44 -40.8 96.43 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.379 172.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.577 HG13 HD11 ' A' ' 984' ' ' ILE . 85.4 t -55.35 -32.36 29.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.2 172.091 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.523 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.6 t70 -80.06 -29.53 39.22 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.806 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.6 mm-40 -64.13 -50.22 69.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.617 1.198 . . . . 0.0 108.828 170.527 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.592 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.0 t -64.55 -23.11 67.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.306 176.312 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.657 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 60.1 tp -57.02 -52.93 70.4 Favored Pre-proline 0 C--O 1.218 -0.558 0 CA-C-O 118.713 -0.661 . . . . 0.0 112.431 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.645 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.4 Cg_exo -58.14 -27.99 82.17 Favored 'Trans proline' 0 C--N 1.357 1.024 0 CA-C-N 121.202 1.465 . . . . 0.0 111.044 169.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 1046 ' ' MET . 3.1 t -78.4 -8.56 11.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.508 176.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.998 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.6 tt -70.92 -52.79 9.4 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 118.942 -0.552 . . . . 0.0 111.077 177.347 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.576 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 32.6 Cg_endo -66.64 -18.57 53.87 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.291 1.327 . . . . 0.0 111.123 173.069 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.89 -55.72 8.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.567 171.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.6 m -171.34 -36.73 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.639 HG22 ' HB ' ' A' ' 984' ' ' ILE . 6.9 m -58.04 -17.18 16.03 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -171.008 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.998 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 5.3 p-80 -48.46 -19.59 0.34 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.811 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 -75.53 -55.19 5.91 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.874 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.001 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -79.41 -40.17 30.68 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.29 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.639 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.7 tp -54.62 -35.89 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.719 -172.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 9.0 pt-20 -76.33 -38.19 56.3 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.884 176.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.719 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 3.6 ptp -59.37 -50.74 72.79 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.832 -173.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.68 ' N ' ' HG3' ' A' ' 986' ' ' MET . . . -78.58 -37.4 42.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.461 -176.434 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.975 ' HA ' HD12 ' A' ' 991' ' ' LEU . 1.4 tm0? -61.86 -40.59 95.88 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.297 -177.255 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 38.6 mmtm -59.54 -40.69 88.03 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 173.663 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -68.27 -36.07 78.85 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.896 -179.168 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.975 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -59.97 -49.38 77.91 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.183 0.516 . . . . 0.0 110.33 178.583 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -54.4 -42.82 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.797 -178.184 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 63.0 m -74.69 -38.87 62.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.175 -176.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.536 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.0 OUTLIER -89.33 -39.59 13.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -169.784 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.917 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.5 tm? -61.08 -31.43 71.1 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 168.744 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.68 -50.0 75.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.594 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.63 -32.36 71.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.807 174.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 1.016 HD21 ' HA ' ' A' 1025 ' ' ALA . 0.2 OUTLIER -65.77 -34.52 78.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.888 0.375 . . . . 0.0 110.463 175.668 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -61.99 -35.7 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.585 0.707 . . . . 0.0 109.385 174.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.724 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.3 m-80 -85.46 -13.16 50.06 Favored 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.507 176.631 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.875 ' HG2' ' HB2' ' A' 1021 ' ' MET . 0.1 OUTLIER -68.76 -40.18 79.87 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.049 0.452 . . . . 0.0 110.251 175.963 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.992 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.8 ptt? -78.64 -34.17 46.66 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.724 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 81.4 tttt -73.48 -55.71 5.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.95 -177.416 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.1 mp -54.42 -45.16 72.92 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.7 84.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.176 0.512 . . . . 0.0 110.067 177.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.885 ' HG3' HG12 ' A' ' 952' ' ' VAL . 15.5 mm100 -78.69 -9.8 59.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.799 0.809 . . . . 0.0 112.09 178.52 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.591 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.3 tp-100 -77.91 -43.76 29.04 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.439 175.798 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.419 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 2.9 t80 . . . . . 0 C--N 1.324 -0.535 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.311 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 CA-C-O 121.275 0.56 . . . . 0.0 110.68 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.9 pt20 -55.15 -33.89 63.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.196 -169.375 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -50.77 -51.12 53.43 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 111.279 173.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.419 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.1 m-30 -76.87 -21.61 54.7 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.512 178.309 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.495 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 38.6 ttpt -65.27 -39.82 93.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.425 177.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.94 -57.06 13.17 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.319 0.58 . . . . 0.0 109.885 176.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -48.85 -49.7 38.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.461 176.161 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.875 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 0.0 OUTLIER -73.81 -19.0 60.88 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.435 -176.759 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.55 -48.09 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.2 m -63.93 -33.76 76.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.361 177.301 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -62.93 -33.6 75.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 178.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 1.016 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -69.69 -31.28 69.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 178.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.536 ' O ' HG23 ' A' 1030 ' ' VAL . 22.5 t-80 -64.88 -34.59 78.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.379 176.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.536 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -57.57 -46.94 83.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.054 175.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.858 HD13 ' HG ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -62.49 -46.27 89.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.88 0.847 . . . . 0.0 110.554 177.39 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.81 -36.98 68.05 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.732 -179.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' 1026 ' ' HIS . 88.6 t -65.9 -35.7 75.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 173.283 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.666 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.72 -39.21 73.52 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.108 -178.478 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.71 -53.43 56.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.073 171.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.597 ' O ' ' HG ' ' A' 1036 ' ' LEU . 2.9 tmtp? -60.32 -48.21 82.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.048 -174.195 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' 1038 ' ' VAL . 8.9 t30 -64.86 -36.53 84.64 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.823 -176.016 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.884 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.98 -33.18 45.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 119.694 -0.193 . . . . 0.0 110.516 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.887 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.2 pp -67.64 -18.35 64.93 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 120.961 0.41 . . . . 0.0 109.899 -178.967 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -88.73 -38.91 14.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.222 169.771 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.001 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -50.68 -61.56 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.938 173.136 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.887 HD11 ' HA ' ' A' 1036 ' ' LEU . 1.7 pp -78.58 -24.22 13.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.125 -178.136 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.686 ' N ' HD12 ' A' 1039 ' ' ILE . 13.8 t0 -59.56 -36.18 75.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 164.809 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.8 mm-40 -72.57 -36.58 68.23 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.678 170.695 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.641 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -51.66 -53.22 41.2 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 123.223 0.327 . . . . 0.0 111.241 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.938 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 7.7 ppt_? -52.42 -38.99 60.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.699 176.009 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.638 ' N ' ' HD2' ' A' 1043 ' ' ARG . 48.2 tp -80.47 -23.42 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 121.001 -0.279 . . . . 0.0 111.29 177.487 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.774 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 28.5 mmmt -62.95 -42.68 99.89 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.668 0.747 . . . . 0.0 109.062 176.077 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.477 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.6 tmt? -61.84 -39.19 90.98 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.191 175.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 37.4 mm -61.05 -36.6 73.59 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.255 173.618 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.0 t -62.4 -21.9 65.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.869 0.366 . . . . 0.0 111.04 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.071 178.615 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.767 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 20.5 tpt180 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 18.3 m 70.88 5.57 5.51 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 123.073 0.549 . . . . 0.0 110.646 -177.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.5 OUTLIER 55.67 78.15 0.2 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.317 171.981 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.514 ' CG ' ' HG3' ' A' 1043 ' ' ARG . 2.4 p30 -55.03 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 112.356 -2.202 . . . . 0.0 112.257 -176.006 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.559 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 3.4 tmtp? -25.38 -25.24 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.238 1.415 . . . . 0.0 114.384 177.092 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.845 HG21 ' HG2' ' A' 1043 ' ' ARG . 13.4 m -62.79 -52.79 55.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 174.263 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.522 ' N ' HG23 ' A' ' 925' ' ' VAL . 60.9 t80 -77.59 -31.17 52.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.163 0.982 . . . . 0.0 108.586 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 930' ' ' THR . 39.8 mt-10 -68.0 -49.77 59.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.931 -179.407 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.559 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 41.3 t30 -73.96 -30.33 62.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.693 HG22 HD11 ' A' ' 965' ' ' LEU . 45.2 t -64.75 -42.39 94.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.811 173.25 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.714 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.7 m -50.57 -29.4 10.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.204 0.526 . . . . 0.0 110.007 165.397 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . 0.407 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -70.77 -27.97 71.52 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.822 178.125 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.766 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.2 tt -64.61 -45.58 86.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.033 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.683 ' O ' HG12 ' A' ' 937' ' ' ILE . 35.2 t -57.04 -45.69 84.05 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.726 173.214 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.714 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.9 mmpt? -56.21 -45.5 79.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.701 178.117 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -77.48 -26.08 51.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.866 -177.41 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.597 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.4 p -80.44 -15.76 12.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.466 172.895 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.683 HG12 ' O ' ' A' ' 933' ' ' VAL . 25.0 mm -69.19 -28.06 37.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.479 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.555 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 11.1 mm-40 -62.49 -47.05 85.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.256 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.493 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 24.1 ttt -57.05 -38.44 73.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.704 174.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.622 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 19.5 m -67.29 -40.73 86.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.127 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.5 t -76.43 -42.78 42.89 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -177.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 7.6 mmtm -48.45 -56.18 8.94 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 113.534 -1.666 . . . . 0.0 111.293 175.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.685 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.4 tt -66.61 -25.26 34.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 123.651 0.594 . . . . 0.0 112.006 -173.518 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.794 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 81.4 mm-40 -51.92 -59.54 8.01 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 119.44 -0.314 . . . . 0.0 111.777 -179.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.794 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.0 Cg_endo -100.64 14.9 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.631 1.554 . . . . 0.0 113.555 174.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.645 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -75.75 137.59 70.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -174.341 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 950' ' ' GLU . 93.3 Cg_endo -85.63 178.74 4.22 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 123.141 2.561 . . . . 0.0 109.47 160.05 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.642 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 8.5 Cg_endo -51.45 -36.66 59.64 Favored 'Trans proline' 0 C--O 1.247 0.97 0 C-N-CA 122.479 2.119 . . . . 0.0 111.943 176.572 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -59.44 -16.16 21.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.582 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.541 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . 0.8 OUTLIER -114.36 -9.49 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.558 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.725 ' O ' ' HG2' ' A' ' 954' ' ' MET . 24.4 m-85 -58.65 -41.83 86.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.584 0.706 . . . . 0.0 109.523 172.702 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -73.68 -52.04 5.01 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.374 177.236 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.2 Cg_exo -56.04 -27.46 64.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.963 1.775 . . . . 0.0 115.152 173.262 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.725 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 24.8 ptt? -68.5 -42.98 77.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.676 0.751 . . . . 0.0 109.601 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.769 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.3 t -71.32 -24.73 24.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.581 174.739 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.615 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 48.0 tttm -56.47 -43.56 79.69 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 173.469 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.449 ' HB3' ' HB2' ' A' ' 938' ' ' GLU . 4.5 mm-40 -54.05 -47.87 71.17 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.106 173.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.578 HG12 ' O ' ' A' ' 955' ' ' VAL . 4.5 p -69.94 -21.12 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.116 177.936 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.615 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -63.59 -41.43 99.13 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 170.575 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 41.6 tp -73.74 -10.18 59.42 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.248 0.547 . . . . 0.0 110.275 175.333 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.766 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -76.14 -56.4 4.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.468 -177.774 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.496 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 59.7 tp -76.02 -17.15 59.8 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.844 0.355 . . . . 0.0 110.43 175.399 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.787 ' HE ' ' HA ' ' A' ' 963' ' ' ARG . 0.3 OUTLIER -64.71 -65.76 0.63 Allowed 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.472 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 6.1 m -58.52 -22.09 54.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.353 175.479 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.693 HD11 HG22 ' A' ' 929' ' ' VAL . 19.8 tp -75.4 -36.81 60.8 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.5 -33.99 56.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.829 172.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -58.46 -49.84 75.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.179 173.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 925' ' ' VAL . 9.4 m -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.961 171.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.9 t -54.79 -32.02 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 122.384 -0.198 . . . . 0.0 110.715 174.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.476 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 10.6 t70 -69.17 -32.31 71.54 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.309 176.319 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 60.1 mm-40 -60.59 -57.86 10.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 122.294 1.045 . . . . 0.0 109.111 172.651 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.531 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.3 t -66.52 -22.69 66.17 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.341 -1.3 . . . . 0.0 112.264 -178.003 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.772 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.1 tp -61.67 -48.61 89.44 Favored Pre-proline 0 C--O 1.217 -0.644 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.082 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.727 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 31.5 Cg_exo -63.54 -26.87 69.71 Favored 'Trans proline' 0 C--N 1.356 0.933 0 CA-C-N 121.58 1.6 . . . . 0.0 110.683 167.904 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.715 HG12 ' HE2' ' A' 1045 ' ' LYS . 19.4 t -74.34 -12.63 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.545 176.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 0.7 OUTLIER -72.16 -54.0 6.06 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.128 177.778 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 24.4 Cg_exo -63.51 -22.61 70.93 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.392 1.395 . . . . 0.0 110.643 178.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -61.25 2.33 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.027 171.759 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.999 ' HB2' ' HD3' ' A' 1045 ' ' LYS . 29.0 m -161.07 -42.62 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.659 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.3 m -45.97 -21.1 0.11 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.14 1.534 . . . . 0.0 115.14 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.703 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 78.7 t60 -47.63 -36.48 10.96 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.726 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 4.9 ptp180 -61.52 -56.07 24.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.739 176.747 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.798 ' HG3' HG22 ' A' 1038 ' ' VAL . 0.6 OUTLIER -76.79 -49.33 16.13 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.141 -0.623 . . . . 0.0 112.025 -174.793 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.661 ' HA ' HG11 ' A' 1038 ' ' VAL . 11.2 tt -50.58 -42.29 21.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.376 -174.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -68.1 -30.17 69.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.982 -177.16 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.68 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.5 ptm -62.51 -57.1 12.39 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.121 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.92 -34.94 38.53 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -176.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -55.48 -52.68 62.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.951 0.405 . . . . 0.0 110.44 -177.407 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -73.16 -23.91 60.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.64 . . . . 0.0 109.854 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.645 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 18.6 tp -65.9 -51.66 56.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.718 175.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.77 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.4 mt -53.08 -52.1 59.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.644 175.264 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -48.09 -43.05 30.36 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.358 178.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 50.4 m -65.02 -50.54 65.86 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.901 -178.001 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.637 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.3 m-20 -94.86 -25.41 16.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -169.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.615 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.9 tm? -52.84 -55.5 22.61 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.859 0.754 . . . . 0.0 109.265 165.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -52.71 -41.16 63.68 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.639 173.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.83 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.5 mm-40 -58.04 -48.58 79.66 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 123.779 0.674 . . . . 0.0 109.782 178.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' 1025 ' ' ALA . 31.2 tp -72.32 -32.79 66.84 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.567 0.542 . . . . 0.0 110.252 -172.426 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.795 ' O ' ' HG2' ' A' 1002 ' ' MET . 37.6 mm -63.5 -56.29 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 122.678 1.227 . . . . 0.0 107.931 173.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.715 ' O ' ' HB2' ' A' 1004 ' ' LEU . 43.0 t30 -58.22 -13.5 5.18 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 113.825 -1.534 . . . . 0.0 112.458 172.047 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.83 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 71.5 mmtt -87.24 -40.42 14.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.223 0.919 . . . . 0.0 111.081 172.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.795 ' HG2' ' O ' ' A' ' 999' ' ' ILE . 12.0 ptt? -61.89 -34.67 76.45 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.742 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.6 ttmt -70.91 -57.98 4.05 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 113.844 -1.525 . . . . 0.0 108.556 172.62 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' A' 1000 ' ' ASN . 2.9 tt -48.33 -57.88 5.38 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.714 0.634 . . . . 0.0 111.589 -173.659 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.407 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -60.1 -48.37 81.99 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.078 0.466 . . . . 0.0 110.562 -175.456 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.478 ' OE1' ' HA ' ' A' ' 948' ' ' PRO . 29.2 mm-40 -79.11 -15.32 58.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.112 -176.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.742 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.0 tp-100 -87.09 -37.94 16.94 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.417 177.851 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.484 ' HD2' ' CG ' ' A' 1017 ' ' TYR . 19.7 t80 . . . . . 0 C--N 1.313 -0.987 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.854 -176.428 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.436 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 0.5 OUTLIER . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.577 ' OE1' ' HD3' ' A' 1018 ' ' LYS . 6.0 tp-100 -51.37 -35.38 38.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.584 -177.077 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' 1019 ' ' LYS . 2.6 tp10 -56.54 -59.62 4.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.338 0.589 . . . . 0.0 111.483 171.589 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' 1017 ' ' TYR . 0.1 OUTLIER -50.06 -39.39 41.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.711 177.466 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.577 ' HD3' ' OE1' ' A' 1015 ' ' GLN . 86.4 tttt -60.98 -31.58 71.17 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.693 -1.14 . . . . 0.0 113.136 177.244 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' 1016 ' ' GLU . 89.8 mttt -58.5 -48.98 79.01 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.639 0.733 . . . . 0.0 109.23 177.028 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -51.96 -43.05 63.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.378 177.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.712 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 14.1 tmm? -65.12 -48.24 74.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.798 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.81 -32.85 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 -175.379 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 30.2 m -68.88 -47.06 66.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.081 0.467 . . . . 0.0 110.202 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.732 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -64.51 -35.62 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.271 177.888 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.786 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -60.87 -42.1 97.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.131 0.491 . . . . 0.0 110.446 176.132 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.572 ' O ' HG23 ' A' 1030 ' ' VAL . 58.1 t60 -69.14 -33.16 73.01 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.138 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.37 -46.92 84.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.119 176.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.567 HD13 ' N ' ' A' ' 995' ' ' LEU . 17.9 tp -59.72 -47.2 86.59 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.268 0.556 . . . . 0.0 110.27 177.206 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -54.69 -32.33 59.28 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.258 174.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 1026 ' ' HIS . 89.9 t -72.46 -40.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 122.076 -0.39 . . . . 0.0 110.546 172.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.637 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 28.0 m-20 -57.7 -47.16 83.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.697 173.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' 1036 ' ' LEU . . . -52.74 -39.45 62.16 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.292 169.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' 1036 ' ' LEU . 35.2 tttm -71.93 -35.08 69.53 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.375 -176.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.593 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -70.8 -54.51 11.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 -178.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.832 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 15.2 tp -64.02 -28.35 69.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' 1040 ' ' ASP . 55.1 tp -51.37 -44.35 62.08 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.685 174.03 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.61 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 19.4 t70 -91.45 -26.92 18.61 Favored 'General case' 0 C--O 1.22 -0.461 0 O-C-N 124.105 0.878 . . . . 0.0 110.692 -179.345 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.832 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 25.2 t -57.42 -57.46 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 123.12 0.568 . . . . 0.0 111.967 177.04 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.728 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.9 pt -86.92 -27.37 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.947 -178.11 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.61 ' HB3' ' HA ' ' A' 1037 ' ' ASP . 2.4 t70 -44.21 -48.38 9.32 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 157.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.675 ' HA ' ' HB3' ' A' 1044 ' ' LEU . 23.4 tt0 -78.23 -23.84 47.24 Favored 'General case' 0 C--O 1.192 -1.936 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.494 176.428 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.851 ' O ' ' HG3' ' A' 1045 ' ' LYS . . . -56.29 -47.36 78.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.619 0.723 . . . . 0.0 111.504 175.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.845 ' HG2' HG21 ' A' ' 925' ' ' VAL . 5.9 mmm180 -79.46 -23.68 42.91 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.469 -0.769 . . . . 0.0 110.917 177.11 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.0 tp -78.38 -29.2 47.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.096 0.474 . . . . 0.0 110.498 175.474 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.999 ' HD3' ' HB2' ' A' ' 979' ' ' SER . 0.1 OUTLIER -71.42 -25.7 62.44 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 176.518 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 59.7 ttp -73.89 -28.69 61.68 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.603 175.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' 1044 ' ' LEU . 45.0 mm -69.89 -32.8 53.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 168.232 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.739 ' HB2' ' O ' ' A' 1045 ' ' LYS . 44.0 m -57.56 -23.75 52.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.245 172.541 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 . . . . . 0 C--N 1.329 -0.306 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.128 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.788 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 21.1 tpt180 . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 47.9 m -61.22 126.55 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 164.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.509 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.1 OUTLIER -64.29 84.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.529 0.681 . . . . 0.0 112.475 -170.599 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.1 t70 -47.04 -174.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.75 -174.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.48 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.9 tmtm? -36.03 -27.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.146 0.978 . . . . 0.0 111.96 -179.869 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.876 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 3.3 m -55.32 -53.64 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-O 119.16 -0.448 . . . . 0.0 112.049 175.19 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 23.5 t80 -75.74 -33.92 60.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.634 -174.091 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -46.36 75.53 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.585 -173.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.48 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 4.1 t30 -73.97 -38.99 64.01 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.677 -174.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.624 HG22 ' CD2' ' A' ' 965' ' ' LEU . 12.0 t -65.24 -33.62 64.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.403 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.485 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 3.9 p -72.73 -27.44 62.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 171.095 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . 0.427 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -60.78 -30.61 73.15 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.342 167.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.813 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -62.86 -38.2 89.89 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 174.901 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.565 ' HA ' HG12 ' A' ' 936' ' ' VAL . 70.3 t -65.27 -41.37 91.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.495 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.587 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.2 mmpt? -60.72 -33.69 73.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.013 0.435 . . . . 0.0 110.284 177.458 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.719 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -78.97 -26.21 43.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.562 -178.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 958' ' ' VAL . 12.9 p -82.87 -12.05 12.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.792 0.806 . . . . 0.0 109.334 171.72 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 59.2 mt -70.55 -41.26 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.092 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.648 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 56.5 mm-40 -53.74 -43.09 68.85 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.038 169.747 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.591 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 24.7 ttt -58.29 -41.15 83.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.562 177.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.701 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 40.6 m -67.83 -41.23 83.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.923 -179.764 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.517 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 11.8 p -76.39 -40.62 50.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -175.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.644 ' HB3' ' HB2' ' A' ' 954' ' ' MET . 7.8 mmtp -53.63 -49.58 67.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.126 178.829 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.586 HD12 ' HE1' ' A' ' 954' ' ' MET . 17.5 tt -71.28 -27.75 30.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.785 -173.437 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.809 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 91.9 mt-30 -56.42 -63.21 3.66 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.42 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.809 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.6 Cg_endo -97.34 -12.12 0.49 Allowed 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.451 1.434 . . . . 0.0 114.378 -175.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -95.86 152.28 38.92 Favored Pre-proline 0 C--N 1.323 -0.573 0 O-C-N 122.073 -0.392 . . . . 0.0 112.007 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 2.8 Cg_exo -76.89 178.7 7.29 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.584 2.856 . . . . 0.0 112.432 -178.212 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.721 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 50.0 Cg_exo -55.88 -27.32 62.37 Favored 'Trans proline' 0 C--O 1.245 0.852 0 C-N-CA 122.821 2.347 . . . . 0.0 112.561 176.233 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -55.73 -27.45 50.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.047 173.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.484 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.7 OUTLIER -102.03 -5.1 24.97 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.342 175.782 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.721 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 6.8 m-30 -56.45 -43.71 79.76 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.108 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -74.68 -51.8 3.87 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 119.97 -0.692 . . . . 0.0 112.159 176.689 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.86 -32.89 48.8 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.167 1.911 . . . . 0.0 113.972 173.632 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.644 ' HB2' ' HB3' ' A' ' 942' ' ' LYS . 0.0 OUTLIER -60.02 -54.91 40.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.878 0.847 . . . . 0.0 110.633 178.553 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.826 ' HB ' ' HB3' ' A' 1002 ' ' MET . 94.2 t -63.22 -26.5 41.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.151 172.539 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 19.2 tptm -65.01 -27.26 68.7 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.046 177.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -59.33 -46.51 88.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.308 172.057 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.856 HG21 HD23 ' A' ' 998' ' ' LEU . 2.5 m -72.29 -24.08 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.24 175.869 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.02 -43.51 57.16 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.265 -0.969 . . . . 0.0 111.141 176.521 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.88 -33.16 68.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.246 170.263 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.813 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.86 -56.48 21.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.32 179.841 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 991' ' ' LEU . 6.9 tt -71.43 -31.62 67.43 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.506 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.07 -55.51 34.04 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.815 -0.553 . . . . 0.0 111.148 171.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 m -58.78 -33.02 69.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.525 0.679 . . . . 0.0 110.339 174.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.647 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 1.8 tm? -63.53 -34.12 77.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.291 174.512 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 35.6 tp -62.46 -25.81 68.18 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.348 178.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.96 -43.05 84.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.175 0.512 . . . . 0.0 110.085 171.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.674 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 6.9 m -61.89 -37.44 84.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.294 173.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 965' ' ' LEU . 97.5 t -58.14 -31.25 41.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.115 174.457 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.47 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 22.0 t70 -76.79 -23.61 52.88 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.067 0.46 . . . . 0.0 110.824 178.405 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 63.8 mm-40 -70.52 -53.71 15.07 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.379 1.085 . . . . 0.0 108.839 169.7 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.716 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.8 t -66.95 -25.95 66.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.149 -178.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 57.3 tp -62.59 -53.21 59.15 Favored Pre-proline 0 C--O 1.218 -0.595 0 CA-C-O 118.863 -0.589 . . . . 0.0 112.297 -176.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.1 Cg_exo -54.86 -32.22 76.48 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 120.928 1.367 . . . . 0.0 111.297 169.193 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.8 t -77.46 -10.47 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.591 177.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.739 ' HG ' ' CB ' ' A' ' 981' ' ' HIS . 2.3 tt -65.59 -53.2 38.84 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.182 176.761 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.623 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 37.6 Cg_exo -61.87 -33.55 84.17 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.353 1.369 . . . . 0.0 110.842 173.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.96 27.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.918 175.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.844 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 8.7 m -170.73 -26.95 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -177.601 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.718 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 37.2 m -63.2 -20.92 65.86 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 -170.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.739 ' CB ' ' HG ' ' A' ' 976' ' ' LEU . 1.8 p80 -50.79 -21.91 1.89 Allowed 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -171.72 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -69.2 -54.5 14.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 119.883 -0.727 . . . . 0.0 110.535 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 1.018 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.99 -43.07 30.66 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.662 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.6 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.6 tp -60.23 -29.14 43.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.512 -175.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.37 -36.67 63.57 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.426 172.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.6 ptm -68.92 -52.73 26.3 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.991 -175.767 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.678 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.19 -46.22 21.05 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.487 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' A' ' 991' ' ' LEU . 23.2 tp60 -60.64 -37.56 81.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.291 -175.126 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -59.6 -41.94 91.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.737 0.78 . . . . 0.0 109.173 174.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 987' ' ' ALA . 0.1 OUTLIER -72.77 -35.68 67.5 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.973 179.417 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 1.034 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.0 mt -60.72 -50.13 74.71 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.626 0.727 . . . . 0.0 109.837 179.164 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -56.67 -41.87 78.01 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.235 -175.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 11.5 p -75.54 -33.2 60.66 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -178.248 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.09 -41.87 10.26 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -171.327 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.6 OUTLIER -59.56 -39.11 82.95 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 171.141 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -54.86 -48.93 72.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.771 178.251 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 993' ' ' SER . 62.6 mm-40 -57.61 -38.93 75.76 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.373 179.434 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.856 HD23 HG21 ' A' ' 958' ' ' VAL . 14.9 tp -70.39 -29.8 66.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.089 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.506 ' O ' ' HG2' ' A' 1002 ' ' MET . 44.4 mt -61.82 -35.75 69.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.893 173.506 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.653 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 41.9 m-80 -88.42 -5.5 58.23 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.101 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 5.2 mptp? -86.19 -34.64 20.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 174.687 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.108 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.9 ptt? -73.47 -35.95 65.77 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 171.978 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.774 ' O ' ' HB2' ' A' 1007 ' ' GLN . 87.3 tttt -62.27 -56.89 14.1 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.213 174.663 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.636 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.0 mp -64.97 -35.79 82.33 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 178.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -63.31 -47.36 82.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.899 0.857 . . . . 0.0 109.851 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -8.4 56.88 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.196 177.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.774 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.0 tp-100 -90.42 -21.18 22.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.397 178.561 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 77.9 t80 . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.807 -174.876 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.224 -0.254 0 CA-C-O 120.77 0.319 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' A' 1019 ' ' LYS . 27.3 pt20 -55.32 -33.9 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.561 -176.412 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.6 tt0 -50.19 -49.17 53.39 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 170.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -80.04 -14.6 58.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 179.228 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.8 tttp -68.63 -36.19 78.28 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 171.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' 1015 ' ' GLN . 32.5 mmtp -68.67 -55.26 12.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.457 176.396 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' 1016 ' ' GLU . 49.5 mm-40 -48.37 -38.42 19.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.849 173.11 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.469 ' HB3' ' O ' ' A' 1018 ' ' LYS . 37.8 ttm -58.79 -57.47 12.86 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 176.346 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.49 -34.97 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -179.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 61.8 m -60.71 -40.17 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.873 177.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.419 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -78.69 -31.28 46.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.507 179.201 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.552 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.15 -41.12 95.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.2 176.348 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.646 ' O ' HG23 ' A' 1030 ' ' VAL . 12.8 t-80 -63.84 -40.0 95.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.949 174.177 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -65.87 -45.94 80.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.07 -179.599 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.1 -28.77 64.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.504 0.668 . . . . 0.0 110.232 178.204 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.479 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.63 -41.43 85.94 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.682 -0.636 . . . . 0.0 109.694 171.483 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' 1026 ' ' HIS . 48.1 t -59.95 -30.75 46.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.468 174.167 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.492 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -76.5 -40.93 48.76 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 109.804 178.723 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.45 -52.64 64.77 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 121.252 0.549 . . . . 0.0 110.718 175.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.59 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 19.7 pttp -65.89 -32.18 73.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -172.055 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.527 ' O ' HG23 ' A' 1038 ' ' VAL . 64.9 t30 -73.6 -35.69 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.139 179.551 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.763 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -76.33 -32.5 58.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 -178.154 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.858 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.4 pp -66.54 -23.61 66.25 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.27 -39.53 25.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.566 169.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 1.018 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -53.58 -65.41 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.117 -0.947 . . . . 0.0 112.792 175.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.876 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -74.86 -27.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.348 -177.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.739 ' H ' HD12 ' A' 1039 ' ' ILE . 11.7 t70 -50.35 -45.56 55.18 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.268 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.732 ' O ' ' HG2' ' A' 1045 ' ' LYS . 47.6 mt-30 -76.75 -28.69 55.84 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.031 176.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.657 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.84 -55.98 19.15 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.973 0.806 . . . . 0.0 111.729 176.536 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.788 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 1.4 mpt_? -58.49 -31.37 67.8 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.924 174.433 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.1 tp -76.38 -20.91 56.7 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.848 175.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.844 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.2 mmtt -67.41 -32.66 73.71 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.151 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 15.5 tmm? -69.12 -37.43 78.34 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.795 176.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.499 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 49.2 mm -65.47 -37.77 80.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.919 172.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.3 m -58.07 -42.62 85.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.721 177.492 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.852 178.594 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.433 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 15.0 tpt180 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 28.1 t -85.04 84.37 7.74 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.616 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -11.61 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.065 1.746 . . . . 0.0 114.114 -175.459 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.885 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 2.2 t0 -47.22 -173.4 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 112.552 -2.113 . . . . 0.0 113.275 -174.238 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.4 tmtp? -37.25 -24.7 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.922 -1.035 . . . . 0.0 112.209 177.594 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.849 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.3 m -56.45 -52.15 56.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 122.615 0.366 . . . . 0.0 111.899 172.955 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.553 ' HD1' ' CD2' ' A' 1036 ' ' LEU . 4.8 t80 -68.88 -29.58 67.9 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -178.173 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 6.3 mm-40 -68.39 -65.55 0.68 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.092 -1.413 . . . . 0.0 113.374 -173.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.685 HD21 ' HB ' ' A' ' 968' ' ' THR . 22.0 p-10 -73.24 -30.73 63.67 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.503 -172.556 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.654 HG22 ' CD1' ' A' ' 965' ' ' LEU . 45.9 t -64.02 -37.15 79.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.335 177.204 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.557 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 12.2 p -73.28 -28.02 61.88 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 171.275 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . 0.516 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -58.52 -28.27 62.15 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 114.699 -1.137 . . . . 0.0 112.546 169.18 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.689 ' HG ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -66.02 -44.58 84.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.552 ' O ' HG12 ' A' ' 937' ' ' ILE . 66.1 t -57.81 -38.06 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.588 172.193 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 930' ' ' THR . 9.8 mmpt? -62.96 -36.12 82.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 175.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.666 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.94 -25.81 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.642 -179.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 14.5 p -81.6 -16.41 12.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.558 172.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 933' ' ' VAL . 47.6 mm -69.26 -37.48 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 165.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.2 mm-40 -53.87 -37.38 63.63 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.704 171.367 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.666 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 59.6 ttp -58.87 -45.65 89.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 31.8 m -71.87 -28.62 63.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 178.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.616 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.0 m -77.36 -41.17 41.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.138 0.971 . . . . 0.0 108.391 -176.48 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.8 mmtp -59.22 -42.07 90.13 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 113.532 -1.667 . . . . 0.0 111.955 179.318 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.457 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.6 tt -71.66 -24.55 23.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.065 -176.168 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.782 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 76.4 mt-30 -55.82 -62.68 4.2 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.782 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -100.49 12.25 0.52 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.749 1.633 . . . . 0.0 114.26 -176.103 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -131.47 155.24 81.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.726 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.3 Cg_endo -93.21 -169.37 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 123.886 3.058 . . . . 0.0 112.701 -177.304 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.726 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 94.7 Cg_exo -49.51 -32.8 28.4 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.282 2.655 . . . . 0.0 113.559 176.464 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.541 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 73.4 mm-40 -53.63 -20.9 5.83 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.917 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.533 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.4 OUTLIER -118.73 -6.86 10.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.565 -178.591 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.758 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.9 m-85 -55.98 -48.55 75.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.136 0.494 . . . . 0.0 109.951 175.139 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.055 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.09 -44.69 3.75 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 119.106 -1.037 . . . . 0.0 111.702 176.829 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.055 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.4 Cg_exo -55.16 -27.98 58.83 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.597 2.198 . . . . 0.0 115.462 172.28 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.758 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 18.6 ptp -69.33 -44.78 70.97 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.182 0.991 . . . . 0.0 108.764 175.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.776 ' CG1' ' HA ' ' A' ' 999' ' ' ILE . 59.4 t -59.91 -27.66 39.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.912 169.547 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.512 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 27.6 ttpt -66.39 -33.13 75.02 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.684 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.06 -45.46 79.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.573 175.691 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.8 m -70.51 -24.99 26.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.266 175.293 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.39 -43.79 36.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.824 177.786 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.9 -24.87 68.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.088 0.471 . . . . 0.0 109.903 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.689 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -65.57 -49.8 67.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.334 173.307 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.876 ' HB2' ' HG ' ' A' ' 995' ' ' LEU . 18.0 tp -59.83 -40.71 89.37 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 172.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -54.87 -55.58 28.89 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.001 0.429 . . . . 0.0 111.15 172.323 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 44.0 m -55.67 -42.44 75.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.723 0.773 . . . . 0.0 110.43 174.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.663 HD21 HD22 ' A' ' 991' ' ' LEU . 9.9 tp -54.53 -40.13 68.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.834 176.248 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.403 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 9.6 tt -59.85 -33.38 71.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.77 -178.645 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.68 86.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.104 0.478 . . . . 0.0 110.261 175.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.843 HG23 HG12 ' A' ' 925' ' ' VAL . 0.8 OUTLIER -70.65 -34.05 71.63 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.825 175.401 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 98.7 t -55.81 -30.28 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 173.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.6 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 24.2 t70 -80.85 -29.52 35.81 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 177.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.3 mm-40 -69.41 -42.82 74.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 123.114 1.435 . . . . 0.0 108.186 171.167 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 1.018 ' HA ' HG22 ' A' ' 975' ' ' VAL . 33.2 t -68.01 -22.73 64.97 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 113.29 -1.777 . . . . 0.0 111.673 174.515 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.5 tt -58.45 -53.46 65.91 Favored Pre-proline 0 C--O 1.213 -0.854 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.082 179.199 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 43.5 Cg_exo -59.73 -34.72 95.99 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-N 121.419 1.542 . . . . 0.0 111.911 173.178 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 1.018 HG22 ' HA ' ' A' ' 972' ' ' SER . 19.7 m -77.23 -10.12 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 118.975 -1.09 . . . . 0.0 111.306 -178.613 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.905 ' HA ' ' HB ' ' A' ' 980' ' ' THR . 3.3 pp -81.98 -40.16 0.95 Allowed Pre-proline 0 CA--C 1.537 0.479 0 CA-C-O 118.307 -0.854 . . . . 0.0 113.187 -177.208 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.477 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 44.1 Cg_endo -69.89 -27.22 26.1 Favored 'Trans proline' 0 C--N 1.36 1.177 0 CA-C-N 121.669 1.632 . . . . 0.0 109.662 172.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.26 9.19 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.554 172.336 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 18.4 m -167.94 -6.55 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.444 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.905 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 88.2 m -88.07 -23.24 23.79 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -169.643 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.583 ' HA ' HG22 ' A' ' 984' ' ' ILE . 19.8 t60 -50.72 -34.93 28.84 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.002 0.819 . . . . 0.0 111.435 -172.973 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -59.78 -52.95 63.26 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.738 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.717 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.1 tp10 -74.71 -47.95 28.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.92 -178.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.744 ' HA ' HG11 ' A' 1038 ' ' VAL . 8.4 tp -54.84 -38.77 45.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -173.261 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.427 ' OE1' ' HA ' ' A' ' 985' ' ' GLU . 5.2 mm-40 -73.13 -27.7 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.881 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.617 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 11.1 ptt? -63.5 -50.52 69.31 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.136 178.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.585 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.29 -42.63 22.73 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.745 -178.601 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.429 HE21 ' HB3' ' A' ' 988' ' ' GLN . 1.0 OUTLIER -61.59 -42.34 98.72 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.028 -173.306 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.547 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 11.0 tmtt? -65.55 -41.39 93.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 175.646 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.76 -50.48 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.167 177.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.663 HD22 HD21 ' A' ' 965' ' ' LEU . 2.9 pp -74.55 -29.32 61.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.761 0.315 . . . . 0.0 111.441 -175.232 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.484 ' N ' HD12 ' A' ' 991' ' ' LEU . 26.7 t-20 -58.14 -43.38 87.29 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.478 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.5 m -76.34 -27.34 56.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.193 -174.249 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -103.98 -44.76 4.93 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -170.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.011 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.77 -50.18 71.14 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.157 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.603 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -57.51 -45.69 84.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.825 176.796 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.73 -35.38 77.9 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 1.2 tm? -72.3 -36.21 68.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.903 -174.124 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.776 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 28.7 pt -65.45 -27.05 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.208 0.528 . . . . 0.0 110.46 177.226 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.605 ' O ' ' HB2' ' A' 1004 ' ' LEU . 53.2 m-80 -93.35 -6.14 47.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.692 175.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.67 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 20.9 tptt -85.31 -46.83 10.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -175.797 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.703 ' HB3' HG21 ' A' ' 955' ' ' VAL . 56.9 tpp -79.85 -32.91 40.51 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.36 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 41.7 ttmt -55.28 -49.06 73.06 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.118 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.605 ' HB2' ' O ' ' A' 1000 ' ' ASN . 28.9 tp -53.86 -50.9 65.24 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.901 0.751 . . . . 0.0 112.293 171.288 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.465 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -58.48 -46.45 86.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.251 0.548 . . . . 0.0 110.979 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.528 ' OE1' ' HB3' ' A' ' 948' ' ' PRO . 20.6 mm-40 -77.43 -7.61 56.44 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.314 178.286 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.2 tp-100 -89.82 -9.41 49.27 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.136 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 57.1 t80 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.068 -178.818 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.809 0.338 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 3.4 pt20 -67.81 -21.82 65.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.822 -175.033 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' 1019 ' ' LYS . 25.8 tt0 -57.89 -55.63 32.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.422 0.629 . . . . 0.0 109.521 174.967 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.487 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 5.7 m-30 -74.94 -15.17 60.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.1 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.585 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 39.3 ttpt -78.19 -42.53 31.19 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.154 -0.219 . . . . 0.0 110.582 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' 1016 ' ' GLU . 17.2 ptpt -69.04 -20.86 64.13 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.615 0.721 . . . . 0.0 109.405 176.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.411 ' HG2' ' HE3' ' A' 1001 ' ' LYS . 6.1 tt0 -78.64 -42.74 27.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.086 177.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.478 ' HG3' ' HA ' ' A' 1018 ' ' LYS . 3.6 ppp? -74.91 -27.13 60.09 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.38 178.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.1 tp -63.56 -44.09 95.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.159 0.504 . . . . 0.0 110.21 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.1 m -65.87 -31.13 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.575 177.6 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.85 -35.16 44.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.17 -31.49 72.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.264 177.146 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.493 ' O ' HG23 ' A' 1030 ' ' VAL . 31.0 t60 -67.51 -34.05 76.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.772 174.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -75.76 -41.65 52.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.164 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.011 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.49 -32.05 67.81 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.337 0.589 . . . . 0.0 110.605 179.953 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.611 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.65 -38.67 72.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.142 0.496 . . . . 0.0 110.314 171.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' 1026 ' ' HIS . 96.2 t -65.81 -34.2 68.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.052 174.594 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.6 p30 -72.76 -39.86 66.48 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.858 -172.546 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.546 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -61.05 -54.31 46.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.084 0.468 . . . . 0.0 110.444 174.459 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.413 ' HA ' ' HB3' ' A' 1036 ' ' LEU . 20.0 ttpt -71.74 -22.89 61.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.372 -173.291 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.473 ' O ' HG23 ' A' 1038 ' ' VAL . 9.7 t30 -73.94 -32.32 63.45 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.168 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 984' ' ' ILE . 19.6 tp -76.46 -33.61 58.72 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.659 ' HA ' HD11 ' A' 1039 ' ' ILE . 0.0 OUTLIER -48.24 -42.56 30.71 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 174.733 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.636 ' N ' HD13 ' A' 1036 ' ' LEU . 23.1 t70 -72.39 -45.3 60.36 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.174 0.511 . . . . 0.0 110.057 177.147 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.744 HG11 ' HA ' ' A' ' 984' ' ' ILE . 40.8 t -48.32 -63.55 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.684 175.673 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.849 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -78.77 -29.01 14.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.098 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.734 ' H ' HD12 ' A' 1039 ' ' ILE . 1.0 OUTLIER -50.53 -48.49 57.19 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 166.09 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.748 ' O ' ' HG2' ' A' 1045 ' ' LYS . 22.7 mt-30 -74.78 -32.49 62.05 Favored 'General case' 0 C--O 1.2 -1.544 0 CA-C-N 113.413 -1.721 . . . . 0.0 111.22 175.592 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.778 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.28 -55.45 21.28 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 118.763 0.711 . . . . 0.0 112.109 178.778 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.885 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 4.0 tpt180 -54.65 -35.95 64.05 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.418 174.296 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.92 -26.17 59.43 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.297 175.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 73.2 mmtt -65.39 -32.79 74.6 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . 0.44 ' HB2' HG12 ' A' ' 975' ' ' VAL . 1.7 tmt? -64.45 -40.02 94.93 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.811 175.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.11 -37.15 79.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.954 172.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . 0.435 ' HB3' ' O ' ' A' 1045 ' ' LYS . 33.2 t -59.19 -37.52 77.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.107 0.48 . . . . 0.0 110.533 177.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . 0.424 HE21 ' HB3' ' A' 1049 ' ' GLN . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.302 178.835 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 920' ' ' ARG . . . . . 0.778 ' CD ' ' HB2' ' A' 1044 ' ' LEU . 4.1 ttt-85 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 33.5 m 60.31 15.36 5.33 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.868 0.467 . . . . 0.0 111.923 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 922' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 43.06 52.46 5.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 123.522 0.729 . . . . 0.0 110.845 -174.479 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 923' ' ' ASP . . . . . 0.477 ' O ' ' N ' ' A' ' 925' ' ' VAL . 23.5 t0 -46.56 -175.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 O-C-N 125.638 1.837 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.651 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.9 tmtm? -34.33 -25.23 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.032 0.933 . . . . 0.0 112.46 178.523 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.755 ' HA ' HG21 ' A' ' 968' ' ' THR . 4.5 m -56.52 -50.66 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 174.028 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' A' 1036 ' ' LEU . 27.2 t80 -76.94 -35.41 57.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -177.476 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.64 -53.65 54.93 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.607 -1.633 . . . . 0.0 111.546 -177.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.18 -44.99 86.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.203 -173.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.909 ' HB ' HD23 ' A' 1036 ' ' LEU . 16.6 t -60.92 -34.84 61.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.076 -0.649 . . . . 0.0 111.217 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.656 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 87.6 m -60.67 -39.37 88.15 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 173.137 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.61 70.01 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 114.982 -1.008 . . . . 0.0 113.318 174.131 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.909 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 10.8 tp -68.41 -35.0 77.01 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 109.51 176.361 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 936' ' ' VAL . 45.9 t -70.33 -38.56 74.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.3 0.571 . . . . 0.0 110.028 172.359 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.656 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -64.29 -25.35 68.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.462 177.23 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.597 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -75.37 -29.96 60.04 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.257 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 10.2 p -79.7 -13.67 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.043 173.29 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 47.0 mm -73.37 -42.48 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 166.202 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.534 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.2 mm-40 -52.6 -41.94 64.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.222 169.273 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.545 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 14.4 ttt -59.09 -41.06 87.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.895 177.756 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.61 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 19.9 m -66.25 -37.07 84.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 941' ' ' SER . . . . . 0.506 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.1 m -77.67 -40.36 41.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -176.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 942' ' ' LYS . . . . . 0.704 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.6 mmtp -62.95 -40.02 96.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.457 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 943' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' A' ' 946' ' ' ALA . 9.5 tp -73.98 -23.19 18.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 O-C-N 123.127 0.267 . . . . 0.0 111.216 -177.831 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 944' ' ' GLN . . . . . 0.667 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 77.6 mt-30 -53.52 -54.09 49.52 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.706 177.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 945' ' ' PRO . . . . . 0.667 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 63.1 Cg_endo -100.54 21.66 0.22 Allowed 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.999 1.799 . . . . 0.0 113.473 173.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 946' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 943' ' ' ILE . . . -89.21 128.57 51.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -173.289 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 947' ' ' PRO . . . . . 0.45 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 1.8 Cg_endo -84.99 179.2 4.32 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.465 2.777 . . . . 0.0 108.489 159.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 948' ' ' PRO . . . . . 0.584 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 7.1 Cg_endo -50.86 -34.64 46.02 Favored 'Trans proline' 0 C--O 1.245 0.829 0 C-N-CA 122.167 1.912 . . . . 0.0 111.731 178.061 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 949' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 17.8 mm-40 -55.6 -37.49 68.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.353 178.224 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 950' ' ' GLU . . . . . 0.547 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.8 mp0 -96.45 -5.55 39.36 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 178.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.584 ' CD1' ' HA ' ' A' ' 948' ' ' PRO . 10.6 m-85 -57.75 -42.12 83.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 172.713 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.016 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -71.79 -51.98 8.43 Favored Pre-proline 0 CA--C 1.555 1.14 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.246 177.168 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.016 ' HD3' HG13 ' A' ' 952' ' ' VAL . 96.8 Cg_exo -51.42 -41.06 61.4 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.734 2.29 . . . . 0.0 115.135 174.629 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.704 ' HB3' ' HB3' ' A' ' 942' ' ' LYS . 14.8 ptt? -60.21 -50.06 75.15 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.706 0.765 . . . . 0.0 110.093 -179.012 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' A' 1002 ' ' MET . 2.7 t -63.54 -26.82 41.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.785 174.302 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 39.1 ttmt -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.1 mm-40 -56.0 -46.96 78.58 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.45 174.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 1.018 HG23 HD22 ' A' ' 998' ' ' LEU . 3.1 m -68.66 -26.27 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.834 177.474 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.455 ' HA2' HD21 ' A' ' 998' ' ' LEU . . . -75.18 -44.11 23.92 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.061 -1.066 . . . . 0.0 112.58 -179.804 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.6 -25.03 64.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.912 0.387 . . . . 0.0 110.482 172.26 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.909 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.24 -52.98 59.94 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.069 174.645 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 1.021 ' HB2' HD23 ' A' ' 995' ' ' LEU . 18.0 tp -53.3 -44.92 68.7 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.055 0.389 . . . . 0.0 111.213 172.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 30.1 mmm180 -56.26 -54.87 40.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.954 0.407 . . . . 0.0 111.122 177.274 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.4 m -53.81 -43.21 69.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.464 0.65 . . . . 0.0 110.945 174.796 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.601 HD21 HD12 ' A' 1035 ' ' LEU . 36.6 tp -61.92 -37.11 83.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.598 179.157 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.0 tp -52.92 -36.56 59.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.182 178.097 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.06 95.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.151 0.5 . . . . 0.0 110.335 174.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 925' ' ' VAL . 5.7 m -66.46 -34.02 77.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 174.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.652 HG13 HD11 ' A' ' 984' ' ' ILE . 73.3 t -55.25 -31.72 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.509 172.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.627 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.9 t70 -76.63 -22.78 53.65 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.242 177.72 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.661 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 50.7 mm-40 -68.99 -50.79 45.9 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 122.972 1.368 . . . . 0.0 108.587 170.128 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.631 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.3 t -65.53 -24.93 67.24 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.34 177.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.69 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.3 tp -61.11 -48.87 90.83 Favored Pre-proline 0 C--O 1.217 -0.616 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.619 -176.319 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 32.3 Cg_exo -61.57 -27.98 82.45 Favored 'Trans proline' 0 C--N 1.355 0.876 0 CA-C-N 121.246 1.481 . . . . 0.0 110.578 170.24 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.6 t -76.86 -10.31 13.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.496 175.676 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 976' ' ' LEU . . . . . 0.69 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 3.7 tt -68.04 -53.82 18.36 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.226 176.303 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 977' ' ' PRO . . . . . 0.62 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.5 Cg_exo -62.9 -24.32 74.22 Favored 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 121.437 1.425 . . . . 0.0 111.054 174.36 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -56.83 11.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.585 172.886 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 4.7 m -169.02 -33.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.728 HG22 ' HB ' ' A' ' 984' ' ' ILE . 8.3 m -54.99 -19.57 7.11 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -174.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.611 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 83.5 t60 -48.5 -20.12 0.4 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.363 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 982' ' ' ARG . 23.6 ttt85 -77.4 -55.52 5.33 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.301 179.203 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.92 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.1 OUTLIER -79.57 -43.76 22.39 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.11 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.728 ' HB ' HG22 ' A' ' 980' ' ' THR . 7.9 tp -56.04 -37.86 50.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.796 -170.406 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 14.7 pt-20 -75.76 -40.71 54.84 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.146 177.034 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.731 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 13.8 ptp -61.25 -50.15 74.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.555 -173.918 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.6 -32.67 47.64 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.204 -177.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 984' ' ' ILE . 8.4 tt0 -62.38 -50.32 72.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.34 -179.887 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -65.16 -32.03 73.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.351 0.596 . . . . 0.0 109.935 175.386 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.3 tp -61.14 -58.86 6.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.353 176.611 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 3.1 pp -70.86 -19.05 62.68 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.447 -176.728 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 996' ' ' ALA . 6.7 t30 -59.61 -38.17 80.59 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 173.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 50.5 m -77.6 -30.47 52.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -178.832 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.649 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.4 m-20 -103.36 -27.49 12.4 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 119.629 -0.828 . . . . 0.0 112.4 -175.473 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.021 HD23 ' HB2' ' A' ' 962' ' ' LEU . 7.1 mp -71.8 -15.74 62.16 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 163.088 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . 0.604 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -68.88 -41.82 77.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.308 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 994' ' ' ASP . 7.8 mm-40 -58.26 -33.21 69.15 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.952 171.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 1.018 HD22 HG23 ' A' ' 958' ' ' VAL . 0.6 OUTLIER -58.33 -35.64 72.19 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.013 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.604 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 1.7 mp -60.24 -42.78 91.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.449 175.4 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.706 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 92.5 m-20 -77.69 -19.37 55.43 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.307 177.284 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.715 ' HD3' ' HA ' ' A' ' 998' ' ' LEU . 9.2 mtpm? -66.9 -44.53 80.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.165 0.507 . . . . 0.0 109.781 174.823 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.925 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 22.3 ptp -76.59 -36.38 57.57 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.789 ' O ' ' HB2' ' A' 1007 ' ' GLN . 23.4 tptm -67.5 -62.59 1.34 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.893 -179.335 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' 1017 ' ' TYR . 2.9 tt -52.19 -56.17 16.33 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.454 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.75 -53.59 56.14 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.301 -174.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -17.99 64.6 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.169 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.789 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.8 tp-100 -88.56 -38.45 14.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.469 0.652 . . . . 0.0 110.755 -176.491 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.586 ' CD2' ' CE1' ' A' 1017 ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.313 -1.018 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.285 -172.476 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.571 ' NE2' ' HD2' ' A' 1017 ' ' TYR . 8.8 tp60 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.725 0.774 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' 1018 ' ' LYS . 0.7 OUTLIER -65.54 -41.08 93.42 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.875 -179.473 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -50.22 -52.13 38.53 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.698 173.138 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.825 ' HB3' HD22 ' A' 1004 ' ' LEU . 0.9 OUTLIER -73.96 -19.44 60.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.343 0.592 . . . . 0.0 110.595 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' 1015 ' ' GLN . 23.1 tptm -71.34 -46.06 61.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.89 171.179 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -58.05 -56.42 22.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.159 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -47.94 -41.32 24.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.825 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.539 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 2.6 ptp -77.27 -23.34 51.2 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.998 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 67.3 tp -69.05 -39.76 78.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.143 0.497 . . . . 0.0 109.944 179.064 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 20.7 m -64.97 -33.75 76.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.05 175.362 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.34 -26.78 46.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.386 177.865 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.83 -37.08 73.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.193 177.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.492 ' O ' HG23 ' A' 1030 ' ' VAL . 20.3 t60 -66.6 -42.91 86.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.63 175.627 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.65 -51.2 68.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.115 178.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -64.75 -33.71 76.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.691 -179.089 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.587 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.06 -43.16 86.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.362 172.908 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' 1026 ' ' HIS . 96.0 t -67.35 -38.97 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 177.186 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.801 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 4.9 m-20 -61.24 -44.49 97.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.846 177.529 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.39 -57.04 12.82 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.964 0.412 . . . . 0.0 110.351 167.651 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' 1036 ' ' LEU . 84.9 mttt -66.22 -22.99 66.35 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -170.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' 1038 ' ' VAL . 66.8 t30 -73.34 -41.15 63.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.776 175.697 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.737 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tm? -75.56 -26.12 57.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.605 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.909 HD23 ' HB ' ' A' ' 929' ' ' VAL . 3.1 tm? -54.35 -52.04 62.86 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.198 169.575 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 18.9 t70 -72.34 -36.17 68.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.646 -178.694 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.92 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.3 t -51.69 -60.8 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.333 174.373 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.706 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 29.1 pt -89.83 -24.48 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -171.711 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -53.63 -48.25 69.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 162.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' A' 1045 ' ' LYS . 31.7 mt-30 -74.43 -21.65 59.51 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.248 176.366 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.706 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.94 -54.04 40.77 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 118.801 0.728 . . . . 0.0 110.625 171.567 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.703 ' HB3' ' HA ' ' A' ' 920' ' ' ARG . 3.3 mpt_? -53.17 -34.79 58.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 173.411 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.778 ' HB2' ' CD ' ' A' ' 920' ' ' ARG . 3.3 tm? -73.73 -34.13 64.64 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.296 173.82 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.8 mmtt -55.81 -28.31 55.63 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.529 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.4 ttm -72.12 -46.76 55.38 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.185 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1047 ' ' ILE . . . . . 0.44 ' HB ' HD22 ' A' 1044 ' ' LEU . 41.0 mm -64.69 -41.85 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.821 175.358 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A 1048 ' ' SER . . . . . . . . . . . . . 20.6 t -52.73 -41.58 64.1 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.301 175.782 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 25.1 tm0? . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.357 -178.766 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.626 ' CG ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.536 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 16.7 m -59.05 141.13 54.82 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 166.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.744 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.32 82.02 0.15 Allowed 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 122.313 0.245 . . . . 0.0 111.422 -174.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 925' ' ' VAL . 3.3 t70 -46.23 -174.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 O-C-N 126.028 2.08 . . . . 0.0 113.055 -170.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.561 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.2 tmtp? -42.97 -19.38 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.281 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.882 ' HA ' HG23 ' A' ' 968' ' ' THR . 2.3 m -60.15 -56.35 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 CA-C-O 118.546 -0.74 . . . . 0.0 111.867 174.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 57.3 t80 -78.67 -25.03 44.82 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 122.425 1.107 . . . . 0.0 108.508 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.471 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 98.3 mt-10 -63.6 -62.82 1.42 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.799 -1.546 . . . . 0.0 111.807 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.42 -32.94 66.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.196 -0.456 . . . . 0.0 112.188 -171.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.819 HG21 HD11 ' A' 1039 ' ' ILE . 19.0 m -60.65 -36.47 70.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.727 0.299 . . . . 0.0 111.512 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.655 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.5 m -61.45 -36.9 81.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.625 -0.879 . . . . 0.0 108.625 171.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.59 -28.95 63.24 Favored Glycine 0 CA--C 1.522 0.504 0 CA-C-N 114.558 -1.201 . . . . 0.0 113.279 175.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 1.07 HD12 HD22 ' A' ' 965' ' ' LEU . 3.1 tt -63.86 -50.74 67.64 Favored 'General case' 0 C--O 1.224 -0.252 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.514 ' O ' HG22 ' A' ' 936' ' ' VAL . 39.4 t -58.51 -42.02 83.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.083 0.468 . . . . 0.0 110.316 178.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.655 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -63.19 -28.81 70.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.115 177.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.564 ' HA ' ' HG2' ' A' ' 938' ' ' GLU . . . -79.37 -25.45 42.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.466 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 0.9 OUTLIER -78.75 -14.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 119.463 -0.895 . . . . 0.0 109.227 173.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.504 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 70.3 mt -69.59 -35.31 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 168.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 13.7 mm-40 -54.59 -38.43 66.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.284 171.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.905 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 44.4 ttm -58.02 -43.36 86.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.144 0.497 . . . . 0.0 110.04 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 14.0 m -68.33 -39.95 81.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.043 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.544 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 17.2 p -76.93 -35.94 56.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -173.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 946' ' ' ALA . 7.4 mmtp -54.78 -47.92 73.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.516 -1.22 . . . . 0.0 112.147 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.547 ' HB ' ' CE ' ' A' ' 954' ' ' MET . 10.8 tt -71.24 -24.37 24.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.435 -174.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.714 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 85.1 mt-30 -57.52 -57.88 22.14 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.9 Cg_endo -96.2 -16.31 0.38 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.46 1.44 . . . . 0.0 114.124 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.512 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -103.35 158.33 32.03 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 -171.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.779 ' HG2' ' HG2' ' A' ' 949' ' ' GLU . 84.0 Cg_endo -92.31 -174.97 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 123.804 3.003 . . . . 0.0 113.155 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.628 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 81.7 Cg_exo -49.83 -31.64 27.05 Favored 'Trans proline' 0 C--N 1.363 1.291 0 C-N-CA 123.719 2.946 . . . . 0.0 114.885 -178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.779 ' HG2' ' HG2' ' A' ' 947' ' ' PRO . 11.7 pt-20 -55.48 -29.5 58.88 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.634 176.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.575 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 51.0 mm-40 -98.14 -5.54 33.36 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.604 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.779 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.8 m-85 -55.0 -46.08 75.12 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.994 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -70.1 -51.96 13.36 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 119.267 -0.973 . . . . 0.0 112.324 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.994 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.9 Cg_exo -53.04 -31.98 56.32 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.731 2.287 . . . . 0.0 115.158 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.905 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.7 ptp -64.8 -39.83 94.23 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.021 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.636 ' O ' HG22 ' A' ' 958' ' ' VAL . 65.7 t -67.12 -28.01 41.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.917 169.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.9 tptm -65.25 -33.82 76.89 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.6 mm-40 -56.31 -47.38 78.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.971 174.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 955' ' ' VAL . 3.2 m -70.36 -25.15 26.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.437 174.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.734 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.03 -45.81 61.28 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.083 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 960' ' ' LEU . 2.3 tm? -62.35 -30.49 71.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.961 0.41 . . . . 0.0 109.917 171.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.734 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.18 -57.01 14.48 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.072 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.946 ' HB2' HD13 ' A' ' 995' ' ' LEU . 2.9 tm? -60.55 -40.62 92.22 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.578 177.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -50.39 -56.59 10.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.555 0.693 . . . . 0.0 110.894 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 6.9 m -53.35 -40.51 64.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.238 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 1.07 HD22 HD12 ' A' ' 932' ' ' LEU . 6.3 mp -68.3 -27.22 66.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.523 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.8 tt -56.96 -36.13 69.94 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.95 -40.53 97.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.284 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.882 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -62.23 -41.4 98.37 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.809 173.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 965' ' ' LEU . 87.9 t -55.11 -31.85 26.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.927 174.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.9 t70 -75.84 -34.09 60.08 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 116.803 -0.181 . . . . 0.0 111.129 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.578 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.8 mm-40 -59.73 -53.13 61.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.515 1.15 . . . . 0.0 108.762 172.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.463 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.0 t -67.57 -22.3 65.4 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.756 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.716 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 28.7 tp -53.3 -55.62 32.57 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 118.579 -0.725 . . . . 0.0 112.144 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.716 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 35.4 Cg_exo -63.8 -23.8 68.8 Favored 'Trans proline' 0 C--N 1.358 1.069 0 CA-C-N 121.127 1.438 . . . . 0.0 111.02 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.532 HG13 ' HB2' ' A' 1046 ' ' MET . 11.5 t -77.51 -8.62 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.162 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.622 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -83.47 -40.14 0.77 Allowed Pre-proline 0 CA--C 1.534 0.364 0 O-C-N 121.363 -0.836 . . . . 0.0 111.951 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.622 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 18.3 Cg_endo -63.99 -23.91 67.44 Favored 'Trans proline' 0 C--N 1.364 1.343 0 CA-C-N 120.797 1.321 . . . . 0.0 110.133 168.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 975' ' ' VAL . . . -64.87 -62.68 1.42 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.148 169.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.867 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.4 m -165.76 -32.31 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.687 HG22 ' HB ' ' A' ' 984' ' ' ILE . 3.4 m -57.27 -18.22 15.47 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.649 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.0 p-80 -48.71 -20.75 0.5 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -174.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -70.97 -57.41 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.486 177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.951 ' HG2' HG22 ' A' 1038 ' ' VAL . 0.0 OUTLIER -82.91 -34.5 26.61 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 -178.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.687 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.2 tp -61.76 -24.48 34.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -177.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -74.78 -48.98 22.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 168.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.733 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 10.6 ptp -63.84 -44.81 92.06 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.781 -171.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.782 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.71 -46.01 19.98 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 1.077 ' HA ' HD12 ' A' ' 991' ' ' LEU . 22.8 tm0? -62.87 -43.77 97.91 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.87 -175.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 54.3 mttp -62.33 -33.9 75.59 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 121.341 0.591 . . . . 0.0 109.7 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.552 ' HG ' ' CB ' ' A' 1031 ' ' ASP . 3.6 tp -71.49 -38.82 71.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.744 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.077 HD12 ' HA ' ' A' ' 988' ' ' GLN . 5.6 mt -61.79 -51.59 67.66 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 121.493 0.663 . . . . 0.0 109.451 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.49 -45.12 77.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.065 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.67 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 50.0 m -64.64 -48.44 74.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.168 -177.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.34 -40.13 8.06 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -167.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.053 ' HA ' HD12 ' A' 1028 ' ' LEU . 3.5 tt -60.99 -41.14 95.9 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.723 175.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -61.43 -42.57 98.95 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 993' ' ' SER . 68.4 mm-40 -52.39 -48.35 65.69 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.088 175.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.536 ' O ' HG11 ' A' ' 955' ' ' VAL . 4.0 mm? -58.55 -37.26 75.32 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.033 0.444 . . . . 0.0 110.191 -175.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -58.04 -44.43 87.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.195 -178.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.701 ' O ' ' HB2' ' A' 1004 ' ' LEU . 16.6 m-80 -93.81 -11.17 31.86 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.483 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.485 ' HA ' ' HD3' ' A' 1001 ' ' LYS . 36.1 mmtm -85.97 -40.66 15.61 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.281 -0.168 . . . . 0.0 111.316 -176.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.683 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 42.5 tpp -77.44 -36.5 53.01 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 172.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.82 ' O ' ' HB2' ' A' 1007 ' ' GLN . 63.0 tttp -53.87 -53.4 53.05 Favored 'General case' 0 C--O 1.211 -0.939 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 171.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.701 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.7 tt -53.06 -52.2 59.31 Favored 'General case' 0 C--O 1.22 -0.482 0 O-C-N 123.932 0.77 . . . . 0.0 111.336 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.464 ' O ' ' HD2' ' A' 1017 ' ' TYR . . . -55.76 -52.22 64.7 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.09 0.472 . . . . 0.0 109.939 -178.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.578 HE21 ' HB3' ' A' ' 948' ' ' PRO . 7.4 mm100 -72.74 -9.83 59.09 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.626 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.82 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.8 tp-100 -95.34 -27.44 15.46 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.399 0.619 . . . . 0.0 110.823 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 23.4 t80 -94.04 -2.07 53.5 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.432 ' HA ' ' OE1' ' A' 1014 ' ' GLN . 5.4 p -28.95 115.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 113.73 -1.577 . . . . 0.0 114.285 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.5 ttt -99.25 -82.55 0.44 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.996 168.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 91.7 m -155.83 -82.07 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 172.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 20.2 m -90.29 -16.95 28.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.46 0.648 . . . . 0.0 109.808 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.641 ' O ' ' HB3' ' A' 1016 ' ' GLU . 17.2 tp -74.0 -5.78 43.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.939 176.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.432 ' OE1' ' HA ' ' A' 1009 ' ' VAL . 8.7 tp60 -57.31 -41.19 79.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.452 0.644 . . . . 0.0 110.429 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.535 ' O ' ' HG2' ' A' 1019 ' ' LYS . 12.4 pt20 -70.22 -26.6 63.94 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.918 -177.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.641 ' HB3' ' O ' ' A' 1013 ' ' LEU . 2.7 tp10 -53.74 -53.82 46.82 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.586 0.231 . . . . 0.0 110.875 166.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.464 ' HD2' ' O ' ' A' 1005 ' ' ALA . 0.4 OUTLIER -64.1 -25.16 67.98 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.529 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 28.8 tptp -74.42 -25.29 59.36 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.389 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' 1015 ' ' GLN . 34.7 mmtp -68.55 -57.67 5.43 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -50.26 -35.08 25.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.323 172.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.423 ' HE2' ' HB2' ' A' 1025 ' ' ALA . 1.7 tmt? -66.4 -43.58 85.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.765 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 41.3 tp -64.49 -39.25 93.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.756 0.312 . . . . 0.0 110.954 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 41.1 m -63.05 -32.88 74.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.596 0.713 . . . . 0.0 110.335 175.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.513 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.12 -39.77 40.23 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.812 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.423 ' HB2' ' HE2' ' A' 1021 ' ' MET . . . -60.4 -35.18 75.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.78 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 11.2 t-80 -62.97 -39.2 93.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.898 174.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.8 82.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.52 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.053 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.94 -34.28 71.32 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.317 0.579 . . . . 0.0 110.296 179.297 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.631 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.59 -32.78 65.56 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.629 -0.67 . . . . 0.0 110.666 171.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 99.3 t -71.7 -27.99 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.68 175.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.552 ' CB ' ' HG ' ' A' ' 990' ' ' LEU . 2.5 p30 -74.27 -40.92 62.01 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 119.632 -0.827 . . . . 0.0 109.478 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -60.28 -49.65 76.78 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.69 ' O ' ' HG ' ' A' 1036 ' ' LEU . 54.1 tptt -59.97 -49.48 77.53 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.787 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.698 ' O ' HG23 ' A' 1038 ' ' VAL . 65.9 t30 -62.76 -43.61 98.36 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.378 -176.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 991' ' ' LEU . 19.1 tp -72.82 -38.08 67.29 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.031 -175.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.74 ' HA ' HG21 ' A' ' 929' ' ' VAL . 3.5 pp -61.0 -19.55 61.45 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-O 120.688 0.28 . . . . 0.0 110.586 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 6.1 t70 -98.52 -33.96 10.79 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.951 HG22 ' HG2' ' A' ' 983' ' ' GLU . 19.9 t -53.11 -58.9 2.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.875 172.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.838 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -83.19 -24.32 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.749 -177.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.697 ' H ' HD12 ' A' 1039 ' ' ILE . 8.6 t70 -58.12 -42.21 85.26 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 163.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' 1045 ' ' LYS . 36.5 mt-30 -68.29 -34.73 76.7 Favored 'General case' 0 C--O 1.2 -1.54 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.888 172.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.756 ' HA ' ' HG2' ' A' 1045 ' ' LYS . . . -52.39 -51.61 58.1 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.891 0.377 . . . . 0.0 110.952 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.744 ' HG3' ' HA ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER -47.28 -41.48 18.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.378 172.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.697 ' N ' ' HD3' ' A' 1043 ' ' ARG . 28.0 tp -80.37 -26.64 38.51 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.966 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.867 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.0 mmmt -64.32 -39.94 94.92 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.532 ' HB2' HG13 ' A' ' 975' ' ' VAL . 13.7 tmm? -63.2 -43.32 98.48 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.913 -1.04 . . . . 0.0 108.705 176.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.567 ' O ' ' HB2' ' A' 1051 ' ' ARG . 41.8 mm -62.71 -44.17 99.25 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 173.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.6 m -47.83 -45.17 29.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.596 177.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -86.98 -56.81 3.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.883 0.373 . . . . 0.0 111.531 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 19.3 t -94.89 32.07 1.73 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.726 -168.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.567 ' HB2' ' O ' ' A' 1047 ' ' ILE . 45.8 ttp180 -64.5 124.07 84.85 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 176.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -44.44 -64.26 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.618 2.879 . . . . 0.0 113.479 -174.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 61.3 m80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.351 -0.833 . . . . 0.0 109.798 178.497 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 4.9 tpp180 . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.4 m -86.37 50.56 2.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.538 ' H ' ' HG3' ' A' 1043 ' ' ARG . 0.2 OUTLIER 42.3 52.45 4.58 Favored 'General case' 0 CA--C 1.498 -1.051 0 C-N-CA 123.494 0.717 . . . . 0.0 111.728 176.1 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.9 t70 -46.77 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 O-C-N 125.694 1.871 . . . . 0.0 112.742 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.729 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.5 tmtp? -36.4 -21.16 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.131 0 C-N-CA 124.212 1.005 . . . . 0.0 112.519 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.743 ' HA ' HG23 ' A' ' 968' ' ' THR . 19.2 m -60.49 -53.84 43.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 C-N-CA 123.284 0.634 . . . . 0.0 112.364 175.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.451 ' N ' HG23 ' A' ' 925' ' ' VAL . 38.5 t80 -79.77 -37.37 35.5 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 122.084 0.945 . . . . 0.0 108.908 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 45.7 mt-10 -58.37 -54.84 42.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.703 -178.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.729 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 65.6 t30 -73.68 -33.01 64.24 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -172.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.644 HG11 ' N ' ' A' 1036 ' ' LEU . 21.3 t -63.06 -32.97 58.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.567 172.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.633 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.8 m -61.31 -35.83 78.43 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 170.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.87 -31.97 69.27 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.18 173.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.932 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.5 tt -64.12 -38.4 90.92 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.606 ' HA ' HG12 ' A' ' 936' ' ' VAL . 22.0 t -69.4 -41.49 80.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.933 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.633 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -58.67 -35.29 72.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.177 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.779 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.38 -24.78 42.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.788 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.606 HG12 ' HA ' ' A' ' 933' ' ' VAL . 9.1 p -83.12 -15.39 11.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 119.18 -1.008 . . . . 0.0 109.406 171.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -68.94 -37.72 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 165.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.743 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.0 mm-40 -52.48 -36.88 55.95 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.744 169.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.556 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.3 tmm? -60.99 -41.92 97.4 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.579 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 50.2 m -73.82 -31.26 63.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.735 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.439 ' OG ' ' HA ' ' A' ' 938' ' ' GLU . 22.9 p -77.05 -43.35 34.79 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.691 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.3 mmtp -52.76 -53.24 50.92 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.187 174.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.854 HG13 ' HE1' ' A' ' 951' ' ' TYR . 14.2 tt -63.58 -23.62 33.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -173.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.8 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 73.7 mt-30 -55.39 -62.79 3.84 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.319 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.8 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 44.4 Cg_endo -97.31 25.47 0.24 Allowed 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 121.631 1.554 . . . . 0.0 114.028 176.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.887 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -113.58 138.8 22.73 Favored Pre-proline 0 C--N 1.33 -0.263 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.66 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 69.0 Cg_endo -88.38 -174.07 1.03 Allowed 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 123.611 2.874 . . . . 0.0 109.972 165.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.783 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 8.1 Cg_endo -51.87 -31.92 44.84 Favored 'Trans proline' 0 C--O 1.247 0.935 0 C-N-CA 122.4 2.067 . . . . 0.0 112.361 176.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.42 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 48.1 mt-10 -52.75 -38.56 61.12 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.775 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.887 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 44.2 mt-10 -104.49 6.42 34.8 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.854 ' HE1' HG13 ' A' ' 943' ' ' ILE . 5.4 m-30 -66.5 -38.3 86.93 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 170.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.112 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -75.87 -47.72 3.79 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.211 174.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.112 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.2 Cg_exo -55.28 -26.5 52.5 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.719 1.612 . . . . 0.0 114.943 172.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.644 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 16.8 ptp -73.37 -36.01 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.172 -1.011 . . . . 0.0 109.596 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.972 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -64.08 -27.47 42.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.424 169.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 20.7 ttmm -58.49 -38.45 77.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 175.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.429 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 4.9 mm-40 -57.87 -48.18 80.58 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.271 178.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 936' ' ' VAL . 6.1 m -73.3 -22.61 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 O-C-N 122.205 -0.31 . . . . 0.0 111.198 177.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.473 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.29 -44.42 34.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.224 -0.989 . . . . 0.0 111.459 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.1 mt -61.28 -26.83 68.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.91 0.386 . . . . 0.0 110.389 171.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.932 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.28 -54.4 37.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.728 174.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 965' ' ' LEU . 3.4 tm? -62.09 -37.15 83.97 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 110.318 -0.252 . . . . 0.0 110.318 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 959' ' ' GLY . 34.1 mmt180 -56.25 -60.22 3.81 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 172.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 2.1 p -52.79 -40.76 63.5 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.194 0.521 . . . . 0.0 110.211 174.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 962' ' ' LEU . 2.7 tm? -57.05 -35.29 69.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.026 178.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.45 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 48.6 tp -64.64 -29.04 70.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.888 0.375 . . . . 0.0 110.496 -178.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.58 96.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.178 0.513 . . . . 0.0 110.097 173.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.743 HG23 ' HA ' ' A' ' 925' ' ' VAL . 4.5 m -64.24 -35.97 82.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.628 173.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.737 HG13 HD11 ' A' ' 984' ' ' ILE . 83.1 t -54.95 -31.09 24.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.726 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.534 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -74.87 -28.3 60.6 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 120.528 0.204 . . . . 0.0 111.485 177.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 23.8 mm-40 -64.79 -53.99 38.25 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 123.027 1.394 . . . . 0.0 108.543 172.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.478 ' HB3' HG23 ' A' 1039 ' ' ILE . 10.4 p -67.24 -22.15 65.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.888 -1.505 . . . . 0.0 111.301 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.708 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 44.6 tp -54.34 -54.67 45.49 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-O 118.938 -0.553 . . . . 0.0 112.127 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.708 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 31.3 Cg_exo -62.39 -25.39 76.22 Favored 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 121.3 1.333 . . . . 0.0 110.941 171.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.576 HG12 ' HB ' ' A' ' 980' ' ' THR . 49.4 t -73.6 -12.88 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.567 174.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.779 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 4.9 tt -74.46 -53.96 3.29 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 118.982 -0.532 . . . . 0.0 111.557 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.3 Cg_exo -62.36 -22.26 73.84 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.111 1.207 . . . . 0.0 110.693 173.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.543 ' HA ' ' HG3' ' A' 1049 ' ' GLN . . . -70.35 -65.13 0.77 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.101 173.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.783 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.1 m -161.38 -32.76 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.788 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -172.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.656 HG22 ' HA ' ' A' ' 976' ' ' LEU . 1.4 t -66.27 -13.82 61.02 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 -173.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.779 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 42.4 t60 -49.83 -21.82 1.26 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.879 0.471 . . . . 0.0 112.097 -174.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.562 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 6.1 ptp180 -78.68 -53.43 7.16 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.024 0.44 . . . . 0.0 110.634 176.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.812 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.2 OUTLIER -77.48 -46.27 23.01 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -175.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.737 HD11 HG13 ' A' ' 969' ' ' VAL . 11.8 tt -55.45 -34.56 34.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.119 0.485 . . . . 0.0 110.112 -174.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -72.94 -34.26 66.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.305 178.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.624 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 23.1 ptm -66.22 -58.04 6.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.332 -0.547 . . . . 0.0 112.006 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.603 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.42 -36.29 33.91 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 6.5 tp60 -67.15 -36.25 81.44 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.774 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -66.86 -31.41 71.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.596 0.712 . . . . 0.0 109.123 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.425 HD11 ' CG ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -71.45 -39.44 70.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.628 178.315 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.797 ' HA ' ' OD1' ' A' ' 994' ' ' ASP . 47.3 mt -74.03 -29.12 61.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.299 -176.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -60.95 -43.62 98.44 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 15.5 m -77.65 -33.85 53.34 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.804 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.797 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p-10 -91.37 -38.07 12.83 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.853 -0.529 . . . . 0.0 111.247 -170.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.518 ' HA ' ' CD1' ' A' 1028 ' ' LEU . 2.7 tm? -59.01 -37.13 76.2 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 170.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.586 ' O ' HG22 ' A' ' 999' ' ' ILE . . . -59.93 -51.85 67.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.224 176.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.65 ' O ' ' HG2' ' A' 1001 ' ' LYS . 2.8 pt-20 -63.7 -35.23 79.88 Favored 'General case' 0 C--O 1.215 -0.731 0 C-N-CA 118.688 -1.205 . . . . 0.0 110.105 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.557 HD11 ' CA ' ' A' 1025 ' ' ALA . 1.8 mm? -69.43 -42.34 75.14 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.898 -0.721 . . . . 0.0 111.689 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.808 ' HA ' HG11 ' A' ' 955' ' ' VAL . 17.4 tt -59.65 -25.36 31.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.009 0.433 . . . . 0.0 110.804 179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.691 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 0.0 OUTLIER -104.03 -7.71 20.1 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.987 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.65 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 31.0 mmtp -83.48 -37.69 22.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.972 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 18.9 mmt -72.91 -41.97 64.04 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.735 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.8 ttpt -58.13 -48.71 79.38 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 114.275 -1.33 . . . . 0.0 109.639 172.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1000 ' ' ASN . 45.7 tp -58.5 -45.74 88.14 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.7 ' HB1' HE22 ' A' 1014 ' ' GLN . . . -63.77 -49.3 73.5 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.372 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.2 pp0? -67.24 -17.64 64.89 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.901 176.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.735 ' HB2' ' O ' ' A' 1003 ' ' LYS . 6.2 tp-100 -77.77 -33.64 52.65 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.6 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.564 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 17.4 t80 -74.04 -76.87 0.12 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.393 -179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.481 HG23 HD13 ' A' 1013 ' ' LEU . 7.5 p 32.33 77.08 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 O-C-N 124.321 1.013 . . . . 0.0 112.438 -177.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' 1008 ' ' TYR . 68.2 mtt -139.6 -103.71 0.16 Allowed 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.804 -178.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 13.1 m -84.21 132.09 34.69 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 175.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 23.9 p 42.42 59.69 2.61 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 -162.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.481 HD13 HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -44.78 -58.09 3.31 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 113.444 -1.707 . . . . 0.0 114.676 -149.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.75 ' HG3' ' HE2' ' A' ' 951' ' ' TYR . 0.6 OUTLIER -88.46 -42.93 11.81 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.557 ' O ' ' HG3' ' A' 1019 ' ' LYS . 45.0 mt-30 -59.8 -48.28 82.3 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -156.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -50.88 -52.13 44.83 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 111.309 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.58 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.7 m-30 -72.09 -24.72 61.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.849 177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.673 ' HA ' ' HB3' ' A' 1021 ' ' MET . 24.3 tttt -67.92 -31.28 70.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.655 0.264 . . . . 0.0 110.52 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' 1015 ' ' GLN . 84.1 mttt -61.45 -57.67 11.28 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.433 ' H ' ' HG3' ' A' 1020 ' ' GLN . 54.2 mt-30 -50.58 -45.44 57.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.476 -1.238 . . . . 0.0 110.999 172.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.673 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 6.4 ttt -56.41 -54.05 50.14 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.527 0.731 . . . . 0.0 112.0 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 3.7 tt -63.93 -45.22 90.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.644 -175.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 17.0 m -61.22 -32.42 72.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.332 0.587 . . . . 0.0 110.612 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.498 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -78.23 -43.56 28.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.98 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.557 ' CA ' HD11 ' A' ' 998' ' ' LEU . . . -59.1 -31.48 68.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.927 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -70.0 -38.44 75.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.435 178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -59.95 -44.11 94.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 174.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.717 ' HA ' ' OD2' ' A' ' 994' ' ' ASP . 1.9 tt -61.76 -54.86 36.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.58 0.705 . . . . 0.0 110.427 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.603 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -56.49 -36.83 69.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.949 -176.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . . . . . . . . . 70.4 t -75.2 -41.68 44.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.808 0.337 . . . . 0.0 110.602 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.471 ' O ' HD21 ' A' ' 991' ' ' LEU . 43.6 m-20 -67.05 -30.0 69.95 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -52.23 -50.91 61.05 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 164.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.525 ' O ' ' HB3' ' A' 1036 ' ' LEU . 58.1 mtmt -64.22 -17.41 63.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.596 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' 1038 ' ' VAL . 59.5 t30 -75.38 -37.3 60.65 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.013 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.696 HD22 HD12 ' A' ' 991' ' ' LEU . 33.3 tp -75.27 -20.44 59.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.644 ' N ' HG11 ' A' ' 929' ' ' VAL . 45.9 tp -57.75 -51.09 71.0 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.28 174.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -31.46 67.08 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.728 178.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.812 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 18.6 t -60.69 -62.45 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.005 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.696 HG22 ' HB ' ' A' ' 925' ' ' VAL . 1.8 mt -77.6 -24.8 14.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.343 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.546 ' O ' ' HB3' ' A' 1043 ' ' ARG . 18.0 t70 -61.81 -37.88 86.05 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.798 165.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.71 ' O ' ' HG2' ' A' 1045 ' ' LYS . 13.3 mm100 -70.74 -32.33 69.46 Favored 'General case' 0 C--O 1.214 -0.8 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.076 171.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.531 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.81 -45.3 74.36 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 121.353 0.597 . . . . 0.0 110.081 171.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.58 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.09 -50.19 15.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.127 170.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.509 ' N ' ' HD3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -79.64 -20.88 45.68 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.374 -0.204 . . . . 0.0 111.416 178.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.783 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 38.0 mmtm -65.22 -40.4 94.03 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 174.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.67 -44.45 96.45 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.946 -1.024 . . . . 0.0 109.412 177.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.427 ' HB ' HD23 ' A' 1044 ' ' LEU . 43.8 mm -64.59 -48.22 85.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.442 174.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -35.28 28.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.073 -0.512 . . . . 0.0 112.125 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.543 ' HG3' ' HA ' ' A' ' 978' ' ' ALA . 1.1 tm0? -79.19 -50.1 11.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 20.1 m -64.78 -47.06 79.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.118 -177.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -173.39 98.24 0.33 Allowed Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.46 -71.87 0.02 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.189 1.926 . . . . 0.0 112.366 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 42.9 m80 . . . . . 0 C--O 1.245 0.866 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.046 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.847 ' HA ' ' HE ' ' A' ' 920' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.648 0 CA-C-O 120.734 0.302 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -82.49 47.48 1.17 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.564 -179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.453 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER 46.84 72.03 0.27 Allowed 'General case' 0 CA--C 1.502 -0.888 0 C-N-CA 123.951 0.9 . . . . 0.0 113.035 174.53 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.941 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 1.9 t70 -45.44 -175.5 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 O-C-N 125.624 1.828 . . . . 0.0 112.873 -176.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.529 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 2.1 tmtp? -42.56 -22.66 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.388 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.858 ' HA ' HG23 ' A' ' 968' ' ' THR . 15.5 m -56.64 -51.61 63.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.716 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.27 174.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.436 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 5.0 t80 -77.61 -34.43 53.44 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 119.179 -1.008 . . . . 0.0 109.348 -175.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -61.68 -49.25 77.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.935 -1.484 . . . . 0.0 111.418 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.437 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.5 -38.21 77.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.539 -176.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 1.073 ' HA ' HD13 ' A' ' 932' ' ' LEU . 2.9 t -66.0 -29.67 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.846 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 38.6 m -61.67 -40.28 94.41 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.08 -27.63 60.16 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 114.568 -1.197 . . . . 0.0 113.351 173.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 1.101 HD11 ' HB2' ' A' ' 965' ' ' LEU . 10.0 mp -64.13 -41.88 97.05 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 117.86 0.83 . . . . 0.0 109.745 174.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.592 ' O ' HG23 ' A' ' 937' ' ' ILE . 77.9 t -70.59 -35.38 61.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.307 0.575 . . . . 0.0 109.909 176.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.2 mmpt? -67.12 -19.14 65.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.168 0.509 . . . . 0.0 109.971 174.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -83.0 -26.54 31.14 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.653 175.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.569 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.5 p -88.13 -15.09 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 120.131 -0.627 . . . . 0.0 110.274 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.592 HG23 ' O ' ' A' ' 933' ' ' VAL . 21.0 pt -75.38 -31.84 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 167.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.9 mm-40 -56.22 -44.84 79.92 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.873 166.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.758 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 26.1 ttt -59.16 -38.98 81.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.726 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.553 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.6 m -67.82 -40.94 83.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.826 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.569 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.4 t -76.05 -41.46 50.62 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -175.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.625 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 10.1 mmtm -47.31 -54.03 12.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.876 176.168 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.629 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 13.6 tt -71.23 -21.51 21.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.548 -174.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.796 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.3 mm-40 -54.74 -63.02 3.24 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.796 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 93.4 Cg_endo -98.69 -5.64 0.75 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.699 1.599 . . . . 0.0 114.178 -176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -111.7 151.63 43.53 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 111.973 0.361 . . . . 0.0 111.973 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.502 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 90.3 Cg_endo -78.79 -176.61 3.37 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.563 2.842 . . . . 0.0 112.796 -176.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.732 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 75.3 Cg_exo -51.98 -25.75 23.03 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 123.133 2.555 . . . . 0.0 113.35 175.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.411 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 30.1 mm-40 -56.82 -30.7 63.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.829 175.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.682 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.9 mp0 -97.63 -1.05 44.56 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.641 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.732 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -57.48 -40.69 79.14 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 170.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.045 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.3 OUTLIER -74.98 -52.45 3.26 Favored Pre-proline 0 CA--C 1.554 1.133 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.115 177.112 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.045 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.72 -32.33 45.03 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.089 1.859 . . . . 0.0 115.031 172.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.758 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 27.3 ptt? -68.53 -44.54 74.38 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 119.921 -0.711 . . . . 0.0 110.227 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.683 ' HB ' ' HB3' ' A' 1002 ' ' MET . 70.2 t -66.23 -26.46 38.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 119.996 -0.682 . . . . 0.0 111.032 170.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 1.6 tmtp? -59.67 -36.99 77.55 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 174.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.2 mm-40 -55.96 -47.35 77.79 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.707 175.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.61 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 3.2 m -73.89 -22.06 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 120.762 0.315 . . . . 0.0 111.241 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.68 -43.47 59.87 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.022 175.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.1 tp -60.29 -23.14 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.345 -0.427 . . . . 0.0 110.512 171.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.856 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.99 -56.36 15.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.776 177.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 991' ' ' LEU . 13.9 tp -62.59 -38.67 91.06 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.987 176.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 20.4 tpp180 -51.4 -62.64 1.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 0.0 111.68 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 20.5 p -56.2 -36.82 68.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.841 0.353 . . . . 0.0 110.927 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 1.101 ' HB2' HD11 ' A' ' 932' ' ' LEU . 31.0 tp -58.08 -34.0 69.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.083 176.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 1.142 ' HA ' HG22 ' A' ' 969' ' ' VAL . 4.1 tt -70.32 -24.08 62.95 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.726 -0.389 . . . . 0.0 111.154 -177.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.96 95.87 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 167.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.858 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.1 m -69.36 -42.04 75.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.077 177.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 1.142 HG22 ' HA ' ' A' ' 966' ' ' LEU . 32.9 m -62.44 -26.34 40.19 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.661 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.561 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 18.5 t70 -73.25 -22.9 60.3 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.541 173.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.646 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.6 mm-40 -74.49 -49.94 20.2 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-O 122.113 0.959 . . . . 0.0 109.296 169.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.628 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 93.6 p -63.9 -26.46 68.61 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.929 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 1.061 ' HA ' HD13 ' A' ' 976' ' ' LEU . 0.9 OUTLIER -59.44 -52.26 75.49 Favored Pre-proline 0 N--CA 1.472 0.647 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.646 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 52.6 Cg_exo -57.2 -26.02 67.53 Favored 'Trans proline' 0 C--N 1.354 0.859 0 CA-C-N 120.687 1.281 . . . . 0.0 110.392 170.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' 1046 ' ' MET . 1.8 t -78.79 -18.83 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.416 175.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 1.061 HD13 ' HA ' ' A' ' 973' ' ' LEU . 8.5 mp -52.66 -58.42 11.99 Favored Pre-proline 0 N--CA 1.476 0.852 0 CA-C-N 118.147 0.43 . . . . 0.0 110.265 172.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.63 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 64.4 Cg_exo -54.81 -38.33 92.11 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 121.839 1.693 . . . . 0.0 111.962 174.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.74 -50.18 74.08 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.111 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.598 ' CB ' ' HG3' ' A' 1045 ' ' LYS . 31.1 t 179.63 -26.43 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.871 0.367 . . . . 0.0 111.287 -179.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.64 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 89.9 m -51.56 -21.0 2.2 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -177.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -52.86 -20.13 3.06 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.675 0.274 . . . . 0.0 111.358 -177.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -76.83 -51.66 10.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.949 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.971 ' HB2' HG12 ' A' 1038 ' ' VAL . 0.5 OUTLIER -65.7 -54.86 21.62 Favored 'General case' 0 CA--C 1.494 -1.205 0 CA-C-O 122.063 0.935 . . . . 0.0 112.142 178.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.947 HG21 ' HG ' ' A' ' 976' ' ' LEU . 9.2 tp -63.73 -34.15 66.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 113.713 -1.585 . . . . 0.0 110.097 -164.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -60.1 -45.39 93.13 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.966 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.55 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 24.5 ptm -73.61 -52.94 11.69 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.201 -175.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.621 ' HB3' HD23 ' A' 1035 ' ' LEU . . . -78.65 -44.94 22.62 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -172.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.705 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.0 OUTLIER -63.44 -44.09 95.54 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.068 -0.253 . . . . 0.0 111.148 -178.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -67.46 -31.92 72.41 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.482 0.658 . . . . 0.0 109.655 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 986' ' ' MET . 0.3 OUTLIER -64.52 -50.86 65.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.465 175.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.739 HD13 HD13 ' A' ' 962' ' ' LEU . 3.5 pp -74.2 -27.35 60.76 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.846 -0.342 . . . . 0.0 111.609 -175.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.545 ' N ' HD12 ' A' ' 991' ' ' LEU . 54.6 t30 -58.17 -42.1 85.29 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.458 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 13.5 m -77.82 -28.36 50.23 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.947 -177.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -95.26 -43.18 8.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -172.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.01 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.88 -44.46 70.47 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 169.336 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.637 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -53.86 -45.76 71.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.258 177.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.701 ' O ' ' HG2' ' A' 1001 ' ' LYS . 22.1 mm-40 -61.36 -34.79 75.88 Favored 'General case' 0 CA--C 1.506 -0.73 0 O-C-N 121.676 -0.64 . . . . 0.0 111.675 178.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.677 ' HG ' HD13 ' A' 1028 ' ' LEU . 2.4 mm? -69.31 -34.76 75.16 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.02 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.637 HG12 ' O ' ' A' ' 996' ' ' ALA . 19.9 pt -73.68 -13.36 15.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 119.764 -0.774 . . . . 0.0 109.938 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.657 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 4.8 p30 -104.15 -3.77 23.99 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 171.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.701 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 42.2 mmtm -85.71 -30.61 23.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 170.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.005 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 25.0 ptt? -72.92 -38.1 66.97 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 171.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.785 ' O ' ' HB2' ' A' 1007 ' ' GLN . 17.7 tppt? -63.02 -53.87 47.02 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.923 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.586 HD12 ' HD3' ' A' 1001 ' ' LYS . 17.1 mt -56.13 -46.81 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.495 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.44 -46.97 88.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.626 0.727 . . . . 0.0 110.373 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.436 ' NE2' HG11 ' A' ' 952' ' ' VAL . 0.3 OUTLIER -75.92 -10.36 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.627 0.727 . . . . 0.0 110.03 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.785 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -88.74 -27.14 21.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.418 -179.151 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.65 19.62 12.52 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.58 -179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.59 ' HA ' ' HG2' ' A' 1014 ' ' GLN . 4.2 p -46.17 97.75 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.795 -1.093 . . . . 0.0 112.693 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.652 ' O ' ' HB2' ' A' 1014 ' ' GLN . 11.2 tpt -146.15 134.36 21.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.108 174.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 27.0 p -42.46 -48.51 5.23 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.0 m -112.22 -24.34 9.89 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.722 -0.391 . . . . 0.0 112.052 -176.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.407 ' HA ' HD13 ' A' 1013 ' ' LEU . 3.9 mm? -82.4 -22.4 35.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' 1010 ' ' MET . 0.0 OUTLIER -54.62 -32.13 58.37 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.895 0.379 . . . . 0.0 110.979 -176.379 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.657 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 3.9 pt20 -54.86 -35.26 63.82 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.064 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.414 ' HA ' ' HE2' ' A' 1019 ' ' LYS . 37.7 tt0 -51.39 -52.56 44.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.826 0.346 . . . . 0.0 111.311 172.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.52 ' CE2' HD22 ' A' 1004 ' ' LEU . 3.2 m-85 -74.99 -21.24 59.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.976 0.417 . . . . 0.0 110.67 178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.657 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 81.5 tttt -66.79 -47.0 73.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.452 176.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.414 ' HE2' ' HA ' ' A' 1016 ' ' GLU . 65.6 pttt -73.65 -19.53 60.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.047 0.451 . . . . 0.0 110.719 -179.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.31 -33.3 37.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.546 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 43.5 ttp -71.66 -39.89 70.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.27 174.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.84 -48.86 72.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.151 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -62.17 -33.29 74.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.406 0.622 . . . . 0.0 110.65 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -76.07 -36.2 59.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.884 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.546 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -61.48 -36.5 80.64 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.493 178.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.502 ' O ' HG23 ' A' 1030 ' ' VAL . 60.2 t60 -63.3 -35.83 81.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.885 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.59 68.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.335 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.01 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.61 -30.66 67.38 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.281 0.563 . . . . 0.0 110.276 178.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.503 ' N ' HD23 ' A' 1028 ' ' LEU . . . -55.84 -40.23 72.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 170.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' 1026 ' ' HIS . 75.1 t -66.95 -33.47 63.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.035 175.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.568 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.2 p30 -70.73 -41.95 71.2 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.295 -177.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.8 66.84 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 171.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 60.1 tttp -59.52 -39.84 85.18 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.748 ' O ' HG23 ' A' 1038 ' ' VAL . 7.5 t30 -68.43 -49.11 62.31 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 121.05 0.453 . . . . 0.0 110.282 -178.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 987' ' ' ALA . 3.3 tm? -67.54 -36.36 80.84 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 -177.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.427 ' N ' HG11 ' A' ' 929' ' ' VAL . 5.2 tt -49.19 -44.11 42.79 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.321 0.649 . . . . 0.0 111.812 175.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' 1040 ' ' ASP . 24.3 t70 -89.0 -41.57 12.28 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.85 -176.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.971 HG12 ' HB2' ' A' ' 983' ' ' GLU . 3.3 t -74.26 -29.42 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' OE1' ' A' ' 983' ' ' GLU . 1.5 tt -81.14 -31.32 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.401 0.68 . . . . 0.0 110.302 170.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.486 ' HB3' ' O ' ' A' 1037 ' ' ASP . 35.3 t0 -52.78 -38.9 61.75 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 161.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' 1038 ' ' VAL . 48.0 mt-30 -76.27 -25.38 54.87 Favored 'General case' 0 C--O 1.206 -1.205 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.887 174.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.739 ' HB2' ' OE1' ' A' ' 983' ' ' GLU . . . -52.42 -56.31 15.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 119.709 1.141 . . . . 0.0 110.428 168.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.941 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 2.7 tpt180 -60.66 -29.77 69.48 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.464 178.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.417 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.5 tp -78.46 -25.36 45.84 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.159 0.504 . . . . 0.0 110.37 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.598 ' HG3' ' CB ' ' A' ' 979' ' ' SER . 3.4 mptp? -62.23 -35.98 80.59 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.886 0.875 . . . . 0.0 109.504 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.77 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.7 tmt? -69.48 -42.31 74.98 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.714 -1.13 . . . . 0.0 109.223 176.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.483 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.9 mm -60.62 -31.75 49.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.719 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.53 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.8 m -64.79 -28.59 69.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.119 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -82.71 -31.48 28.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.947 0.403 . . . . 0.0 110.469 178.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.5 t -82.81 -17.88 42.47 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.84 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.654 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 66.7 ttt180 -56.45 -55.95 37.09 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-N 115.777 -0.647 . . . . 0.0 112.608 -175.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 1.3 Cg_endo -83.46 14.81 2.27 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.275 1.983 . . . . 0.0 113.509 -176.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 79.8 t60 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.568 -177.791 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.814 ' HD2' ' HB2' ' A' 1044 ' ' LEU . 15.0 ttt180 . . . . . 0 CA--C 1.529 0.171 0 CA-C-O 121.089 0.471 . . . . 0.0 111.944 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 3.0 t -111.31 29.27 7.96 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.447 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 48.27 59.45 4.28 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.738 -175.422 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.0 t70 -47.33 -173.54 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 O-C-N 125.631 1.832 . . . . 0.0 112.363 -176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.52 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.3 tmtp? -37.78 -25.05 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.374 1.07 . . . . 0.0 112.067 -177.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.722 ' HB ' HG13 ' A' 1039 ' ' ILE . 10.3 m -59.9 -49.79 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.059 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.632 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 62.2 t80 -75.93 -40.3 54.42 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 119.566 -0.853 . . . . 0.0 109.208 -178.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -60.96 -47.88 84.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.225 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.4 t-20 -72.18 -42.93 65.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.786 -173.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.66 ' CG2' HD11 ' A' 1039 ' ' ILE . 47.1 t -65.02 -30.17 49.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.676 178.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 51.8 m -60.85 -32.53 71.94 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 168.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.87 74.18 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.323 -1.308 . . . . 0.0 113.264 173.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.882 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.1 tt -61.78 -44.05 97.63 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 118.42 1.11 . . . . 0.0 108.314 175.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 937' ' ' ILE . 43.4 t -55.79 -44.1 76.26 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 176.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.1 mmpt? -61.58 -38.21 86.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.861 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.82 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.55 -25.58 38.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.893 -177.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.674 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.1 p -80.28 -15.58 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 C-N-CA 119.726 -0.789 . . . . 0.0 109.057 170.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 933' ' ' VAL . 20.5 mm -71.46 -35.37 56.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 166.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.633 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 70.4 mm-40 -52.85 -42.4 65.18 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.824 169.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.565 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 35.7 ttp -57.65 -46.69 83.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.485 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.582 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.4 p -72.75 -26.75 61.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.914 0.388 . . . . 0.0 110.979 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.489 ' HA ' ' NE2' ' A' ' 944' ' ' GLN . 20.2 m -78.82 -43.34 25.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.67 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.7 mmtp -54.58 -49.66 69.86 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 113.209 -1.814 . . . . 0.0 111.193 177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.846 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.6 tt -65.57 -28.69 44.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 123.137 0.273 . . . . 0.0 111.599 -176.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.793 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 69.1 mt-30 -50.06 -61.11 4.02 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.793 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 64.1 Cg_endo -97.78 16.73 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.562 1.508 . . . . 0.0 113.821 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.83 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -100.86 148.58 35.24 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -173.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 79.6 Cg_endo -86.4 -178.68 2.82 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.433 2.755 . . . . 0.0 110.231 165.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.864 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 10.0 Cg_endo -51.62 -34.63 53.78 Favored 'Trans proline' 0 C--O 1.249 1.057 0 C-N-CA 122.648 2.232 . . . . 0.0 112.73 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.534 ' O ' ' HD2' ' A' ' 953' ' ' PRO . 25.0 mt-10 -54.0 -39.05 65.72 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.018 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.83 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -95.83 2.42 53.74 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.864 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 21.0 m-30 -65.7 -38.56 89.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 172.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.983 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.34 -55.47 6.05 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 119.536 -0.866 . . . . 0.0 111.511 174.117 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.983 ' HD3' HG13 ' A' ' 952' ' ' VAL . 75.2 Cg_exo -51.02 -32.07 37.29 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 122.124 1.883 . . . . 0.0 115.166 173.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.846 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.9 ptt? -65.93 -45.18 82.8 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 121.502 -0.749 . . . . 0.0 110.157 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.698 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.8 t -69.94 -25.52 28.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.202 0.525 . . . . 0.0 110.022 173.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 61.0 tttm -61.2 -37.93 84.75 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.7 mm-40 -54.23 -44.61 71.87 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.494 172.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.674 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.7 t -65.57 -28.64 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.497 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.596 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.72 -43.45 51.32 Favored Glycine 0 C--N 1.328 0.131 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.561 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.4 mm? -62.74 -32.28 73.37 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 172.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.882 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -54.3 -56.13 21.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.012 176.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.785 HD11 HD13 ' A' ' 991' ' ' LEU . 61.1 tp -66.53 -36.47 82.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 44.3 ttt180 -58.11 -49.68 76.11 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.741 -0.599 . . . . 0.0 110.71 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 26.8 m -53.69 -35.78 61.47 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.124 173.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.717 HD11 ' HB2' ' A' ' 932' ' ' LEU . 7.2 mt -66.02 -38.03 87.41 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 120.847 0.356 . . . . 0.0 110.134 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 6.8 tt -52.17 -32.65 37.04 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.203 177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.41 -47.63 63.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.462 HG22 ' O ' ' A' ' 965' ' ' LEU . 6.8 t -69.56 -32.35 71.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.314 0.578 . . . . 0.0 110.109 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.923 HG13 HD11 ' A' ' 984' ' ' ILE . 45.5 t -55.5 -32.5 30.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.126 169.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.736 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 27.6 t70 -71.08 -25.38 62.6 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-O 120.636 0.255 . . . . 0.0 110.875 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 975' ' ' VAL . 5.4 mm-40 -65.52 -49.69 68.03 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.984 1.373 . . . . 0.0 108.408 169.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.587 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.2 t -65.87 -24.28 66.83 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 113.834 -1.53 . . . . 0.0 111.766 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.708 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.2 OUTLIER -61.58 -53.21 63.61 Favored Pre-proline 0 C--O 1.215 -0.761 0 CA-C-O 118.52 -0.752 . . . . 0.0 111.791 -176.496 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 6.9 Cg_endo -54.77 -28.44 57.48 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 121.497 1.57 . . . . 0.0 111.584 168.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.71 -11.59 13.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.881 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.914 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -67.58 -51.97 29.2 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-O 118.965 -0.541 . . . . 0.0 111.316 176.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.578 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 32.5 Cg_exo -60.83 -33.01 93.37 Favored 'Trans proline' 0 C--N 1.363 1.297 0 C-N-CA 121.503 1.468 . . . . 0.0 110.715 173.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -60.13 -54.89 40.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.873 175.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.864 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -168.74 -39.86 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.78 HG22 ' HB ' ' A' ' 984' ' ' ILE . 17.4 m -52.46 -20.2 2.72 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -170.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.914 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 19.1 p-80 -49.66 -22.19 1.26 Allowed 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -171.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -70.24 -54.78 11.3 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.171 -0.612 . . . . 0.0 111.299 178.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.885 ' HB3' HG22 ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.14 -41.82 40.3 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 179.372 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.923 HD11 HG13 ' A' ' 969' ' ' VAL . 10.8 tp -60.87 -30.6 47.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.395 -171.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -73.87 -42.82 60.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.173 174.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.596 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 18.1 ptp -64.34 -52.83 56.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -173.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.839 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -75.94 -35.57 59.66 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 119.352 -0.356 . . . . 0.0 111.61 -174.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.573 ' NE2' HG13 ' A' ' 984' ' ' ILE . 32.9 mt-30 -57.97 -54.98 40.83 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.815 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -57.89 -36.6 72.64 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 121.802 0.81 . . . . 0.0 109.454 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.616 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 14.0 tp -60.63 -62.06 2.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.963 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.995 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 1.3 pp -73.1 -23.23 60.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -172.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.501 ' N ' HD12 ' A' ' 991' ' ' LEU . 24.2 t-20 -64.69 -35.66 81.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 23.7 m -76.04 -36.83 58.93 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.886 -178.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.05 -32.77 13.66 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.323 -171.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.025 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.7 tm? -58.46 -38.0 76.62 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.469 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -67.72 -41.17 83.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.631 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 6.9 mm-40 -53.61 -44.3 69.34 Favored 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.3 172.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.572 ' HB3' ' CG1' ' A' ' 955' ' ' VAL . 4.2 mm? -69.56 -29.31 66.84 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 120.465 -0.494 . . . . 0.0 109.981 178.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.722 ' O ' ' HG2' ' A' 1002 ' ' MET . 43.8 mt -61.14 -45.5 98.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.545 174.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.631 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 2.9 p30 -82.91 -15.26 52.1 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 121.985 -0.447 . . . . 0.0 111.292 178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.62 ' HA ' ' CB ' ' A' 1004 ' ' LEU . 66.1 mttm -86.37 -26.58 24.74 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.478 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.869 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 21.1 ptt? -73.93 -34.24 64.26 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.922 ' O ' ' HB2' ' A' 1007 ' ' GLN . 39.6 ttpt -73.91 -18.03 60.96 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 113.324 -1.762 . . . . 0.0 109.573 172.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.62 ' CB ' ' HA ' ' A' 1001 ' ' LYS . 35.9 tp -85.84 -54.72 4.34 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.178 0.924 . . . . 0.0 110.646 -173.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.22 -38.62 83.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.263 0.554 . . . . 0.0 109.848 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -23.92 54.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.059 177.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.922 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.9 tp-100 -69.89 -42.16 73.79 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.355 0.598 . . . . 0.0 109.75 177.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.3 OUTLIER -70.4 -62.92 1.2 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.483 177.213 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.419 ' O ' HG22 ' A' 1009 ' ' VAL . 8.5 p 40.77 34.14 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 124.714 1.259 . . . . 0.0 112.541 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.514 ' HA ' ' CE ' ' A' 1010 ' ' MET . 1.5 tpt -93.74 98.87 11.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 172.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 7.0 t -32.75 -49.26 0.22 Allowed 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.791 1.404 . . . . 0.0 114.791 -165.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.9 m -79.57 -43.91 22.09 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.735 -176.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 3.6 mm? -85.36 -7.65 58.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.86 0.362 . . . . 0.0 111.394 -175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.494 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.2 tm0? -60.23 -33.15 71.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.227 -176.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -58.5 -37.06 74.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.561 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -50.09 -39.84 43.74 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.775 0.321 . . . . 0.0 111.673 173.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 5.6 m-30 -84.89 -24.0 28.68 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.831 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.494 ' HB2' HE22 ' A' 1014 ' ' GLN . 76.1 tttt -69.74 -44.47 70.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.826 0.346 . . . . 0.0 110.401 174.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -57.95 -57.47 12.66 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.475 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -57.04 -37.21 71.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.71 176.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.474 ' HE2' ' HA ' ' A' 1018 ' ' LYS . 40.5 ttp -64.73 -42.15 95.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.802 0.335 . . . . 0.0 110.934 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 59.1 tp -66.06 -41.7 90.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.943 0.402 . . . . 0.0 110.72 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 4.5 m -65.42 -30.08 70.85 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.856 0.836 . . . . 0.0 109.99 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.442 ' C ' HD21 ' A' ' 998' ' ' LEU . . . -78.91 -40.08 33.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.695 -1.138 . . . . 0.0 109.91 -177.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -60.13 -31.59 70.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.518 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.63 ' O ' HG23 ' A' 1030 ' ' VAL . 15.2 t-80 -65.13 -38.22 89.95 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 174.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -66.81 -46.79 74.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.209 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.025 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.87 -32.58 73.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 109.988 179.566 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.626 ' N ' HD23 ' A' 1028 ' ' LEU . . . -60.52 -33.96 73.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.475 170.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' 1026 ' ' HIS . 85.9 t -75.82 -32.45 23.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.132 0.491 . . . . 0.0 109.828 177.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.995 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 7.5 m-20 -59.34 -44.43 92.64 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.237 172.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.591 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -58.2 -52.97 63.34 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.793 170.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 1.6 tmtp? -53.47 -38.49 63.66 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.276 -177.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.611 ' O ' HG23 ' A' 1038 ' ' VAL . 66.5 t30 -71.88 -39.89 69.31 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.911 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.793 HD22 HD21 ' A' ' 991' ' ' LEU . 17.1 tp -74.23 -29.52 61.74 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 121.279 -0.168 . . . . 0.0 110.657 -176.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.641 ' HB3' ' CG1' ' A' ' 929' ' ' VAL . 4.7 pp -70.5 -26.66 63.7 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.35 -39.68 38.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 174.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.885 HG22 ' HB3' ' A' ' 983' ' ' GLU . 19.5 t -51.77 -56.15 6.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.163 174.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.722 HG13 ' HB ' ' A' ' 925' ' ' VAL . 20.5 pt -94.24 -26.48 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 -170.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.632 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 2.8 t0 -55.25 -42.63 73.72 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.366 -0.933 . . . . 0.0 108.511 162.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.673 ' O ' ' HG2' ' A' 1045 ' ' LYS . 21.8 mt-30 -77.61 -22.67 50.45 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.676 175.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.52 -50.79 64.69 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 121.055 0.455 . . . . 0.0 110.463 169.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.688 ' HG2' HG21 ' A' ' 925' ' ' VAL . 16.8 mmt180 -54.73 -38.12 66.74 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.093 0.473 . . . . 0.0 110.434 172.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.814 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 56.9 tp -69.48 -28.39 66.04 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.286 174.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.864 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 24.5 mmtp -67.84 -40.9 83.66 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.861 0.839 . . . . 0.0 109.133 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 26.6 ttt -59.23 -46.44 88.47 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.161 -1.381 . . . . 0.0 108.889 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.9 -50.8 78.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.011 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.1 m -41.84 -47.96 4.28 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -96.71 -36.55 10.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -174.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 6.4 m -86.44 -30.85 21.74 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 -173.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -146.89 74.6 12.12 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.07 137.75 81.36 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 123.006 2.47 . . . . 0.0 112.729 -173.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 33.6 t60 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.852 -0.594 . . . . 0.0 109.888 179.284 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.72 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 8.4 tpt180 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.408 ' HB3' ' O ' ' A' ' 920' ' ' ARG . 22.7 t 76.88 26.96 0.75 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.393 0.616 . . . . 0.0 110.054 -173.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.506 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 46.93 69.79 0.46 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.706 168.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.5 t70 -47.05 -174.81 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.648 -1.615 . . . . 0.0 112.67 -178.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.402 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 1.2 tmtp? -40.12 -23.05 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.998 0.919 . . . . 0.0 112.169 -177.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.672 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 7.5 m -56.36 -50.28 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 172.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.506 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 7.6 t80 -75.08 -29.75 60.76 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.011 0.91 . . . . 0.0 108.8 -176.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.37 -56.22 9.25 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.615 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.423 HD22 ' C ' ' A' ' 928' ' ' ASN . 0.2 OUTLIER -69.81 -38.75 76.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.677 -175.636 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.936 ' HB ' HD11 ' A' 1039 ' ' ILE . 9.5 p -60.41 -34.13 56.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.904 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 93.4 m -69.1 -35.66 76.71 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.47 -28.03 61.7 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.618 174.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.916 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.1 tt -66.83 -46.8 73.96 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 937' ' ' ILE . 17.7 t -59.59 -39.85 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.165 176.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.666 ' O ' HG12 ' A' ' 937' ' ' ILE . 10.0 mmpt? -70.3 -19.03 63.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.102 0.477 . . . . 0.0 110.435 177.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.728 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.63 -25.33 33.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.92 0.39 . . . . 0.0 110.623 175.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.587 ' O ' ' HB3' ' A' ' 939' ' ' MET . 11.1 p -86.41 -10.09 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 119.482 -0.887 . . . . 0.0 109.927 172.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 934' ' ' LYS . 5.6 pt -83.48 -27.24 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 165.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.627 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.3 mt-10 -57.64 -39.29 76.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 164.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.613 ' HG2' ' SD ' ' A' ' 954' ' ' MET . 1.7 tmt? -57.07 -45.6 83.13 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.054 176.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 21.0 m -67.65 -30.06 69.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.99 179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.424 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.1 m -79.62 -46.67 16.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.995 0.902 . . . . 0.0 108.677 -175.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.56 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 3.3 tmtm? -56.86 -45.61 82.35 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 113.366 -1.743 . . . . 0.0 110.786 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.1 tt -67.69 -30.34 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 O-C-N 123.302 0.376 . . . . 0.0 111.772 -176.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.803 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.4 mt-30 -50.09 -60.01 5.97 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-O 119.481 -0.295 . . . . 0.0 111.762 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 77.5 Cg_endo -97.37 34.8 0.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.513 1.475 . . . . 0.0 112.935 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -120.43 141.37 31.88 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.534 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 86.7 Cg_endo -88.7 -179.33 2.19 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 123.19 2.593 . . . . 0.0 109.718 165.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.638 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 9.1 Cg_endo -50.87 -32.37 37.24 Favored 'Trans proline' 0 C--O 1.247 0.932 0 C-N-CA 122.5 2.134 . . . . 0.0 112.451 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -54.6 -43.7 72.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.962 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.675 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.8 mp0 -95.71 1.72 53.58 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.537 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.638 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 5.9 m-30 -61.01 -48.25 82.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.519 -0.473 . . . . 0.0 109.786 176.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.027 HG13 ' HD3' ' A' ' 953' ' ' PRO . 1.3 p -75.72 -42.71 3.86 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.294 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.027 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.5 Cg_exo -52.68 -30.69 47.08 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.459 2.106 . . . . 0.0 113.753 168.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 33.8 ttp -56.88 -54.13 50.03 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 122.119 0.962 . . . . 0.0 109.189 174.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.537 HG11 ' HA ' ' A' ' 999' ' ' ILE . 42.0 t -60.64 -28.17 42.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.555 -1.202 . . . . 0.0 111.33 172.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 82.0 tttt -59.37 -38.28 80.05 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.485 ' OE1' ' HB3' ' A' ' 938' ' ' GLU . 38.9 mt-10 -59.11 -46.0 89.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.248 176.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.841 HG21 HD21 ' A' 1028 ' ' LEU . 10.0 p -75.11 -22.08 16.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 120.116 -0.633 . . . . 0.0 111.416 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.424 ' HA2' ' CD1' ' A' ' 995' ' ' LEU . . . -71.89 -43.83 48.72 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.646 176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.6 mt -60.78 -23.69 65.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.025 0.44 . . . . 0.0 110.732 172.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.42 -55.67 30.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.846 175.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.548 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 35.0 tp -64.37 -35.02 79.52 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.165 177.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 10.2 tpt180 -55.07 -57.73 10.55 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.187 0.518 . . . . 0.0 111.195 171.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 12.7 m -57.34 -38.14 73.65 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 110.646 175.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.799 HD21 HD23 ' A' 1035 ' ' LEU . 56.1 tp -64.64 -28.07 69.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.069 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.447 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 54.2 tp -62.29 -33.19 74.18 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.69 93.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.198 0.523 . . . . 0.0 110.034 172.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.672 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.8 m -67.59 -37.91 83.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.882 173.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 965' ' ' LEU . 93.8 t -56.47 -30.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.204 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.606 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.4 t70 -77.64 -22.29 50.93 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.429 178.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.633 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 41.8 mm-40 -71.82 -50.41 29.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 122.718 1.247 . . . . 0.0 108.499 170.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.635 ' OG ' HG21 ' A' ' 980' ' ' THR . 47.8 t -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.685 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.757 ' HA ' HD23 ' A' ' 976' ' ' LEU . 7.4 tt -60.87 -54.39 54.86 Favored Pre-proline 0 C--O 1.213 -0.827 0 CA-C-O 118.445 -0.788 . . . . 0.0 112.156 -176.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.643 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 38.0 Cg_exo -59.5 -27.49 85.09 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 121.613 1.612 . . . . 0.0 110.486 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.535 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.1 t -75.72 -14.2 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.982 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.954 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.6 pp -76.81 -41.98 2.77 Favored Pre-proline 0 CA--C 1.539 0.529 0 CA-C-O 118.456 -0.783 . . . . 0.0 112.762 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.954 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 17.2 Cg_exo -69.03 -28.98 28.09 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.068 1.417 . . . . 0.0 110.118 172.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.32 -55.75 28.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.23 171.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.838 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 38.6 m -162.7 -42.04 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.833 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 93.6 m -51.53 -26.99 9.52 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 -171.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.721 ' HA ' HG22 ' A' ' 984' ' ' ILE . 11.6 p80 -50.97 -39.12 54.59 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.1 0.864 . . . . 0.0 112.723 -165.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.4 mtm180 -53.73 -50.85 65.04 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.537 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.831 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.7 -48.35 32.73 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.841 -178.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.721 HG22 ' HA ' ' A' ' 981' ' ' HIS . 9.7 tp -60.4 -30.2 45.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.162 -174.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.65 -35.86 75.57 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.712 -0.222 . . . . 0.0 111.027 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.669 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 15.6 ptm -66.78 -52.69 41.12 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.292 -0.563 . . . . 0.0 111.455 -176.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.711 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -80.41 -44.75 18.81 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -174.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.474 ' HA ' ' HG ' ' A' ' 991' ' ' LEU . 24.1 tm0? -64.24 -35.29 80.32 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.033 -173.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -66.11 -42.49 89.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.415 0.626 . . . . 0.0 109.515 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.8 -49.56 75.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.261 178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.645 HD21 HD22 ' A' 1035 ' ' LEU . 2.4 pp -73.92 -29.39 62.02 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -173.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.524 ' N ' HD12 ' A' ' 991' ' ' LEU . 6.8 t30 -57.81 -43.34 85.65 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 m -76.6 -25.21 53.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.92 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -101.29 -45.56 5.3 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -172.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.935 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.31 -52.7 62.6 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.334 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.53 -43.99 80.37 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.517 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' 1001 ' ' LYS . 62.1 tt0 -54.23 -41.06 68.27 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 121.079 -0.248 . . . . 0.0 111.548 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.647 HD12 ' HB3' ' A' 1001 ' ' LYS . 46.0 tp -70.05 -31.22 68.73 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.693 -175.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' 1003 ' ' LYS . 59.3 mt -58.96 -35.05 54.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.332 0.586 . . . . 0.0 109.862 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.452 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 35.5 m-80 -95.66 -10.16 30.12 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.771 178.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.647 ' HB3' HD12 ' A' ' 998' ' ' LEU . 27.1 tptt -82.75 -48.4 10.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -176.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.594 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 7.8 tpt -79.58 -26.39 41.32 Favored 'General case' 0 N--CA 1.438 -1.037 0 C-N-CA 119.522 -0.871 . . . . 0.0 109.223 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.715 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.5 tttm -56.16 -48.96 75.31 Favored 'General case' 0 C--O 1.207 -1.133 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 168.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.449 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 31.7 tp -58.31 -43.73 88.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.351 174.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -64.16 -42.08 96.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.05 0.452 . . . . 0.0 110.926 178.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.54 -12.54 60.04 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.218 177.231 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.715 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.3 tp-100 -85.09 -23.27 28.57 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.993 -1.003 . . . . 0.0 109.563 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.537 ' CE2' ' HB3' ' A' 1013 ' ' LEU . 0.1 OUTLIER -85.3 -56.73 3.39 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.042 176.353 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 9.2 p 34.39 67.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 124.651 1.219 . . . . 0.0 112.92 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.924 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 26.4 mmt -121.76 153.41 38.31 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.012 -0.994 . . . . 0.0 108.74 176.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 32.9 p -52.26 -56.35 15.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -170.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.6 p -99.07 -20.23 16.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.98 0.419 . . . . 0.0 111.446 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.924 ' HB2' ' HB2' ' A' 1010 ' ' MET . 2.9 mm? -86.21 -20.05 29.1 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -174.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.596 ' HB2' ' O ' ' A' 1010 ' ' MET . 0.8 OUTLIER -61.57 -48.72 79.71 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -179.065 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -60.3 -37.4 80.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.809 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.448 ' O ' ' HG3' ' A' 1020 ' ' GLN . 15.0 tp10 -50.78 -50.38 56.19 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.673 172.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.479 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-30 -72.32 -25.57 61.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.792 0.33 . . . . 0.0 111.445 178.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' 1021 ' ' MET . 62.1 tttm -70.2 -36.04 74.33 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.319 0.581 . . . . 0.0 109.848 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 78.2 tttt -65.82 -29.75 70.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.267 174.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' 1016 ' ' GLU . 79.1 mt-30 -83.84 -38.33 21.34 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.213 -0.903 . . . . 0.0 109.992 -176.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -71.59 -25.94 62.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.854 177.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 2.9 tm? -64.82 -42.18 95.17 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 16.7 m -58.91 -35.55 73.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.452 176.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' 1001 ' ' LYS . . . -79.06 -38.82 35.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.441 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -61.69 -32.65 72.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.098 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.512 ' O ' HG23 ' A' 1030 ' ' VAL . 77.9 t60 -72.9 -40.89 65.18 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.151 176.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.28 -37.6 87.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.204 0.526 . . . . 0.0 109.851 176.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.935 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -60.2 -50.33 74.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.583 173.568 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.2 -40.11 70.38 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.374 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' 1026 ' ' HIS . 97.5 t -65.75 -33.15 61.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 175.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.689 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.81 -39.32 73.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.857 -0.737 . . . . 0.0 109.948 -177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.793 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.15 -53.69 51.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.54 170.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.813 ' HA ' HD23 ' A' 1036 ' ' LEU . 96.9 mttt -63.77 -32.47 73.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.844 0.354 . . . . 0.0 111.94 -175.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' 1038 ' ' VAL . 7.0 t30 -69.79 -36.88 76.07 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.006 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.799 HD23 HD21 ' A' ' 965' ' ' LEU . 13.6 tp -77.65 -24.17 49.51 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.486 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.891 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.5 OUTLIER -59.42 -43.76 93.0 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' 1041 ' ' GLN . 33.6 t70 -73.94 -22.6 59.6 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.217 177.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.831 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 15.1 t -76.89 -46.87 28.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.855 178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.936 HD11 ' HB ' ' A' ' 929' ' ' VAL . 8.0 pt -92.62 -31.69 4.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -175.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.578 ' HB3' ' O ' ' A' 1036 ' ' LEU . 0.5 OUTLIER -54.1 -48.43 70.71 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 163.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.645 ' HG2' HD12 ' A' 1044 ' ' LEU . 25.1 mt-30 -75.37 -22.33 57.6 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 115.063 -0.972 . . . . 0.0 111.201 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.712 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.4 -52.75 62.53 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-O 121.382 0.611 . . . . 0.0 110.255 165.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.748 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 1.2 mpt_? -59.39 -28.26 66.73 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.74 173.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.645 HD12 ' HG2' ' A' 1041 ' ' GLN . 84.0 mt -78.76 -23.37 45.38 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.108 173.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.838 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 48.6 mmtm -63.28 -36.21 82.93 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 170.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 2.0 tmt? -67.65 -39.84 84.58 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.268 176.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 43.9 mm -60.5 -38.93 79.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.685 172.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.7 m -64.53 -41.45 96.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.601 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -73.51 -44.82 56.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.057 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 22.7 t -68.61 -34.86 76.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.014 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 63.44 92.7 0.06 OUTLIER Pre-proline 0 N--CA 1.463 0.222 0 O-C-N 123.581 0.551 . . . . 0.0 111.438 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.481 ' HG2' ' CD2' ' A' 1053 ' ' HIS . 72.4 Cg_endo -79.38 -7.16 14.92 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.377 2.051 . . . . 0.0 111.242 174.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.481 ' CD2' ' HG2' ' A' 1052 ' ' PRO . 6.2 p80 . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.817 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.58 ' HB2' HG13 ' A' 1047 ' ' ILE . 3.8 tpt180 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 29.9 m -85.49 27.62 0.82 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.629 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.61 68.76 0.78 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.862 0.865 . . . . 0.0 112.148 175.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.747 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.3 t70 -47.68 -171.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.497 -2.138 . . . . 0.0 112.511 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.667 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.0 tmtm? -27.92 -26.9 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.16 1.384 . . . . 0.0 113.8 177.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.846 HG21 ' HB2' ' A' 1043 ' ' ARG . 3.9 m -57.33 -52.65 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 174.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -77.28 -26.21 52.15 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.776 0.798 . . . . 0.0 108.996 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 34.0 mt-10 -66.79 -62.28 1.53 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.761 -1.108 . . . . 0.0 112.097 -178.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.483 ' HB2' ' CD ' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.91 -32.53 67.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.788 -0.187 . . . . 0.0 111.141 -172.452 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.952 HG11 ' HA ' ' A' 1036 ' ' LEU . 10.7 p -61.38 -31.76 51.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.888 175.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.574 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 91.6 m -63.46 -38.08 89.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 169.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . 0.455 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -59.09 -27.63 62.78 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 114.942 -1.027 . . . . 0.0 112.865 173.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.953 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 15.7 tp -66.03 -34.35 77.88 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.607 ' O ' HG12 ' A' ' 937' ' ' ILE . 57.7 t -77.01 -37.7 26.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.293 173.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.5 mmpt? -58.85 -37.57 76.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.875 0.369 . . . . 0.0 111.155 178.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 1.116 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -80.1 -24.64 40.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.708 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.589 HG12 ' HA ' ' A' ' 933' ' ' VAL . 14.5 p -79.47 -15.33 13.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.045 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 933' ' ' VAL . 44.1 mm -74.62 -38.53 45.59 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 165.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.655 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 19.2 mm-40 -52.45 -46.28 66.39 Favored 'General case' 0 CA--C 1.506 -0.716 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 167.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.607 ' HG2' ' HE2' ' A' ' 954' ' ' MET . 29.3 ttp -58.32 -37.0 74.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.667 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.59 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 46.1 m -74.29 -37.96 63.51 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.625 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.503 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 28.3 m -78.82 -44.27 23.43 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.979 0.895 . . . . 0.0 109.452 -175.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.717 ' HD2' ' HB2' ' A' ' 954' ' ' MET . 4.5 tmtm? -59.89 -34.75 73.58 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.383 -178.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.553 HD12 ' HE1' ' A' ' 954' ' ' MET . 7.6 tt -77.35 -24.99 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 O-C-N 123.0 0.187 . . . . 0.0 111.143 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.743 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 87.1 mm-40 -51.39 -55.65 27.18 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.575 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.743 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.8 Cg_endo -99.89 31.59 0.1 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.148 1.899 . . . . 0.0 112.697 175.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.675 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -102.87 126.27 33.09 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -172.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.412 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 67.7 Cg_endo -77.26 171.88 17.0 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.75 2.3 . . . . 0.0 109.298 160.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.569 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 6.3 Cg_endo -50.01 -38.71 49.76 Favored 'Trans proline' 0 C--O 1.245 0.843 0 C-N-CA 122.581 2.188 . . . . 0.0 112.689 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.06 -23.95 65.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.668 ' HB3' ' HE3' ' A' ' 942' ' ' LYS . 20.4 mm-40 -102.39 -15.66 16.46 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.327 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB2' ' HG3' ' A' 1006 ' ' GLN . 26.8 m-85 -55.03 -51.44 66.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.295 0.569 . . . . 0.0 109.644 174.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.001 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -66.91 -42.75 44.69 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.728 -178.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.001 ' HD3' HG13 ' A' ' 952' ' ' VAL . 73.8 Cg_exo -58.26 -35.1 99.04 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 121.639 1.559 . . . . 0.0 113.555 168.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.717 ' HB2' ' HD2' ' A' ' 942' ' ' LYS . 0.3 OUTLIER -62.44 -50.19 72.46 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.865 0.84 . . . . 0.0 109.737 177.492 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.615 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -60.41 -26.32 36.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.22 172.516 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 2.6 ttpm? -66.37 -35.16 79.63 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.8 mm-40 -56.51 -46.73 80.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.049 178.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.568 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 12.2 p -69.71 -22.64 25.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.957 176.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.417 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -69.24 -43.31 71.7 Favored Glycine 0 N--CA 1.453 -0.198 0 C-N-CA 120.116 -1.04 . . . . 0.0 111.507 175.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.83 -22.2 65.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 111.067 172.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 1.116 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -63.47 -57.63 9.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.251 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 965' ' ' LEU . 16.9 tp -68.82 -32.55 72.33 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.495 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 29.6 tpt180 -57.48 -60.5 3.55 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.427 HG22 ' OD1' ' A' ' 928' ' ' ASN . 22.5 m -55.31 -34.8 64.48 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.848 0.832 . . . . 0.0 110.293 175.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.786 HD12 HD12 ' A' ' 962' ' ' LEU . 2.6 tm? -64.52 -28.73 69.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.577 176.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 85.8 mt -67.5 -28.96 68.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.612 0.244 . . . . 0.0 110.654 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.56 -42.91 98.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.439 0.638 . . . . 0.0 109.497 172.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.783 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.8 m -62.36 -40.04 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.927 172.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.844 HG13 HD11 ' A' ' 984' ' ' ILE . 54.4 t -55.62 -31.26 28.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.197 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.563 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.0 t70 -74.46 -22.42 59.11 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.636 0.255 . . . . 0.0 110.97 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.63 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 59.6 mm-40 -71.95 -46.53 57.12 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 122.635 1.207 . . . . 0.0 109.317 169.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.438 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 28.5 t -66.32 -24.64 66.57 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.59 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.625 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.0 tp -60.57 -50.14 86.81 Favored Pre-proline 0 C--O 1.22 -0.498 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.248 -177.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.63 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.6 Cg_exo -58.12 -28.27 83.06 Favored 'Trans proline' 0 C--N 1.358 1.062 0 CA-C-N 121.02 1.4 . . . . 0.0 110.868 169.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.612 HG11 ' O ' ' A' 1042 ' ' ALA . 40.9 t -74.45 -15.76 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.547 176.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.767 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 2.2 tt -67.92 -52.72 23.24 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.157 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.544 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 35.8 Cg_exo -61.62 -29.07 83.52 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.155 1.237 . . . . 0.0 110.719 172.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -66.52 -59.39 3.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.392 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.557 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 68.8 m -163.9 -39.03 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -173.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 976' ' ' LEU . 2.0 t -62.11 -16.14 50.36 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -169.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.767 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 35.7 t60 -48.44 -21.55 0.57 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.806 0.443 . . . . 0.0 112.073 -177.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 11.1 tpp180 -77.66 -54.36 6.47 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.324 0.583 . . . . 0.0 110.379 176.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.887 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.65 -46.54 25.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.312 -176.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.844 HD11 HG13 ' A' ' 969' ' ' VAL . 12.6 tt -57.8 -32.96 44.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.228 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.58 -35.26 67.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.363 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.716 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.1 ptp -61.53 -61.5 2.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 120.382 -0.527 . . . . 0.0 111.746 -176.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.726 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.42 -34.94 31.24 Favored 'General case' 0 C--O 1.216 -0.66 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.504 ' NE2' HG11 ' A' ' 969' ' ' VAL . 45.2 tt0 -64.05 -47.76 78.91 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 118.59 0.632 . . . . 0.0 111.25 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -68.56 -27.9 66.48 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.529 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 7.3 tp -63.65 -42.99 98.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.857 176.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.726 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 92.6 mt -68.13 -31.29 70.78 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.035 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -56.4 -47.18 79.51 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -76.35 -31.42 58.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.715 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.568 ' OD1' ' HA ' ' A' ' 991' ' ' LEU . 1.7 p30 -91.37 -52.09 4.97 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 120.069 -0.652 . . . . 0.0 112.435 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.039 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -53.05 -52.03 59.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.23 -46.7 87.78 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.18 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 7.8 pt-20 -65.11 -32.6 74.38 Favored 'General case' 0 C--O 1.212 -0.909 0 C-N-CA 119.164 -1.015 . . . . 0.0 110.581 -177.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.683 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 3.0 mm? -66.38 -41.86 88.77 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.647 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.506 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.3 mt -52.99 -40.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.981 173.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.508 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 51.3 m-20 -88.41 -10.07 50.49 Favored 'General case' 0 C--O 1.213 -0.854 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.343 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.683 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -85.77 -39.26 17.32 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -176.786 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.691 ' SD ' ' HD2' ' A' ' 951' ' ' TYR . 0.1 OUTLIER -78.72 -36.57 43.16 Favored 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 174.601 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.692 ' O ' ' HB2' ' A' 1007 ' ' GLN . 76.0 tttt -60.48 -52.48 65.02 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.139 173.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 13.7 mt -57.47 -41.17 80.11 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 174.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.796 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -61.62 -45.8 92.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.334 0.588 . . . . 0.0 110.496 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.739 ' HG3' ' HB2' ' A' ' 951' ' ' TYR . 11.7 mm-40 -77.63 -9.55 59.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.733 0.778 . . . . 0.0 110.34 176.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.692 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.4 OUTLIER -87.55 -5.31 58.82 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.256 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.563 ' CE2' ' HB3' ' A' 1013 ' ' LEU . 79.5 t80 -126.54 2.64 6.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.694 -1.139 . . . . 0.0 109.784 179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.767 HG23 ' HG3' ' A' 1014 ' ' GLN . 7.4 p -53.0 117.32 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.897 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 48.0 tpp -132.49 -78.5 0.5 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.593 174.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 4.3 p -144.19 -97.74 0.11 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.936 176.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 47.4 t -72.26 -27.17 62.32 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 174.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.626 ' H ' HD12 ' A' 1013 ' ' LEU . 5.4 mp -59.24 -31.35 68.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.631 177.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.767 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -63.74 -50.78 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -179.473 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -60.88 -37.73 83.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.482 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -49.88 -50.03 47.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 173.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.796 ' HD2' ' HA ' ' A' 1005 ' ' ALA . 1.1 m-30 -71.04 -28.15 64.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.559 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.503 ' HB2' HE22 ' A' 1014 ' ' GLN . 28.8 ttpp -74.86 -25.12 58.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.207 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 46.4 tttp -65.86 -61.0 2.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.173 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -48.03 -41.83 26.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.759 168.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.625 ' HG3' ' HE3' ' A' 1002 ' ' MET . 1.8 tmt? -63.42 -44.64 94.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.837 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 50.8 tp -60.5 -37.66 81.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.779 0.324 . . . . 0.0 111.42 -177.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 25.9 m -68.93 -31.77 70.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.573 0.702 . . . . 0.0 110.15 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.403 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -79.25 -39.26 33.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.86 -178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.455 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -63.84 -36.28 83.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.758 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 63.6 t60 -66.52 -31.16 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.493 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.94 -50.54 55.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.375 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.039 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -66.97 -32.07 73.07 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.15 0.5 . . . . 0.0 109.755 -175.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.63 ' N ' HD23 ' A' 1028 ' ' LEU . . . -61.69 -44.84 96.17 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.091 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 64.5 t -77.25 -18.99 14.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.547 ' C ' HD21 ' A' ' 991' ' ' LEU . 69.3 m-20 -85.73 -34.42 21.23 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.702 176.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.633 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -53.83 -49.14 69.06 Favored 'General case' 0 C--N 1.345 0.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 161.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.763 ' HA ' HD23 ' A' 1036 ' ' LEU . 56.8 tttm -61.14 -28.38 69.06 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.638 177.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.587 ' O ' HG23 ' A' 1038 ' ' VAL . 67.2 t30 -74.74 -34.32 62.5 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.9 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.705 ' CD2' HD11 ' A' ' 965' ' ' LEU . 25.1 tp -78.09 -23.69 47.86 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.688 -177.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.952 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.2 pp -63.6 -43.27 97.39 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 175.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.415 ' N ' HD12 ' A' 1036 ' ' LEU . 16.5 t70 -62.68 -43.73 98.05 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.101 175.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.887 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 44.2 t -53.4 -69.68 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.379 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.575 176.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.931 HD11 ' HB ' ' A' ' 929' ' ' VAL . 7.1 pt -77.94 -26.51 14.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.2 t70 -49.94 -48.21 52.05 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 163.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.424 ' O ' ' N ' ' A' 1045 ' ' LYS . 27.1 mt-30 -78.72 -24.54 44.87 Favored 'General case' 0 C--O 1.205 -1.262 0 CA-C-N 114.356 -1.293 . . . . 0.0 111.192 177.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.719 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.88 -56.01 24.16 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 118.921 0.782 . . . . 0.0 111.537 171.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.846 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.0 OUTLIER -55.68 -30.38 60.97 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.564 176.194 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 41.6 tp -74.77 -37.27 62.49 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.591 172.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 13.6 mptt -53.68 -38.98 64.74 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 124.018 0.927 . . . . 0.0 109.869 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.8 ttt -60.54 -44.59 95.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.583 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 920' ' ' ARG . 43.3 mm -70.52 -28.7 35.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.448 176.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 67.8 m -58.9 -54.65 44.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.412 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -80.06 -12.34 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.34 0.591 . . . . 0.0 110.114 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.534 ' O ' ' HD3' ' A' 1052 ' ' PRO . 28.3 t -83.51 -1.03 52.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.561 0.696 . . . . 0.0 109.608 173.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 6.3 tpm_? -107.26 92.06 7.57 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.818 175.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.534 ' HD3' ' O ' ' A' 1050 ' ' SER . 16.6 Cg_exo -69.1 136.3 34.37 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.478 2.118 . . . . 0.0 111.279 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 57.9 m-70 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.309 -0.853 . . . . 0.0 109.542 178.536 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.871 ' HD3' ' HB2' ' A' 1044 ' ' LEU . 2.0 ttt-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 43.5 t 62.66 10.3 4.07 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 122.703 0.401 . . . . 0.0 111.695 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 46.02 52.74 9.79 Favored 'General case' 0 CA--C 1.498 -1.045 0 C-N-CA 123.364 0.666 . . . . 0.0 110.85 -176.146 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.485 ' O ' ' N ' ' A' ' 925' ' ' VAL . 9.4 t70 -45.58 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 125.817 1.948 . . . . 0.0 112.182 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.661 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.6 tmtp? -44.82 -14.18 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.515 0.726 . . . . 0.0 111.722 -178.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.833 ' HA ' HG23 ' A' ' 968' ' ' THR . 9.8 m -63.15 -53.3 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.15 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.573 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 59.2 t80 -77.62 -28.35 51.43 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.661 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.6 mt-10 -62.71 -66.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.175 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.525 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 2.5 t30 -66.71 -36.17 81.85 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.264 -172.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.861 ' HA ' HD13 ' A' ' 932' ' ' LEU . 9.9 p -61.66 -39.48 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-O 120.932 0.396 . . . . 0.0 111.339 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.564 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 59.9 m -66.24 -33.36 75.57 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.26 -30.04 60.76 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 114.55 -1.204 . . . . 0.0 112.757 172.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 1.041 HD11 ' HB2' ' A' ' 965' ' ' LEU . 6.9 mp -63.04 -45.85 90.33 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 117.941 0.871 . . . . 0.0 109.622 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 936' ' ' VAL . 61.8 t -63.21 -37.34 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.648 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -68.4 -31.57 71.02 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.209 0.528 . . . . 0.0 110.373 175.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -77.56 -25.32 49.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.172 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.563 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -81.3 -6.71 10.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 119.714 -0.794 . . . . 0.0 109.34 172.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.564 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 66.1 mt -75.91 -33.75 26.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 165.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.613 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 24.6 mm-40 -53.24 -40.7 64.79 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.66 168.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.918 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 15.5 tmm? -58.12 -46.9 84.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.941 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.601 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 46.9 m -64.08 -33.08 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.201 179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.716 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 13.3 m -77.46 -45.49 25.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.953 0.882 . . . . 0.0 108.938 -176.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.554 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 8.5 mmtp -55.94 -47.1 78.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.499 -1.682 . . . . 0.0 112.063 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.615 ' HA ' ' OE1' ' A' ' 950' ' ' GLU . 10.9 tt -68.89 -28.89 41.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.515 -174.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.625 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 75.8 mt-30 -53.28 -62.03 4.12 Favored Pre-proline 0 CA--C 1.539 0.558 0 N-CA-C 113.257 0.836 . . . . 0.0 113.257 -178.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.716 ' HD3' ' O ' ' A' ' 941' ' ' SER . 5.7 Cg_exo -77.64 -35.69 1.44 Allowed 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.703 1.602 . . . . 0.0 114.88 -170.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.441 ' HB3' ' CG ' ' A' ' 950' ' ' GLU . . . -105.92 164.21 15.47 Favored Pre-proline 0 CA--C 1.535 0.382 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -167.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.642 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 10.8 Cg_exo -74.26 179.99 5.29 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 123.845 3.03 . . . . 0.0 110.94 169.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -48.69 -15.56 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 124.134 3.223 . . . . 0.0 115.323 -171.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 7.0 pt-20 -57.72 -20.07 31.91 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.395 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.642 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.2 OUTLIER -87.78 -22.01 24.78 Favored 'General case' 0 CA--C 1.511 -0.524 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.659 174.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.712 ' HD2' ' HA ' ' A' 1002 ' ' MET . 0.3 OUTLIER -56.22 -50.47 71.18 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 123.814 0.697 . . . . 0.0 110.245 -172.246 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.993 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -75.11 -45.04 4.74 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.635 178.574 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.993 ' HD3' HG13 ' A' ' 952' ' ' VAL . 85.4 Cg_exo -56.74 -27.49 71.3 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 121.599 1.532 . . . . 0.0 114.731 172.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.918 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 26.4 ptt? -74.61 -35.68 62.94 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.758 179.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 1.053 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -63.21 -27.49 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.473 170.543 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.72 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.7 ttpp -56.07 -41.73 75.55 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.1 mm-40 -58.26 -46.25 86.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.36 -1.291 . . . . 0.0 111.558 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.563 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.3 m -74.36 -28.46 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.8 -42.35 38.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.048 -1.073 . . . . 0.0 111.861 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 57.2 tp -58.61 -34.52 71.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.244 0.545 . . . . 0.0 109.595 171.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.61 -48.42 81.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.736 174.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 17.9 tp -68.7 -36.85 78.99 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.726 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 46.6 ttp180 -63.77 -47.9 79.09 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.605 -0.684 . . . . 0.0 111.595 176.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 p -56.81 -35.7 69.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.318 0.58 . . . . 0.0 109.869 171.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 1.041 ' HB2' HD11 ' A' ' 932' ' ' LEU . 63.7 tp -64.41 -34.51 78.34 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.84 176.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 88.5 mt -58.25 -33.82 69.79 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.099 178.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.4 -43.06 91.8 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.63 0.728 . . . . 0.0 109.647 173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.833 HG23 ' HA ' ' A' ' 925' ' ' VAL . 6.2 m -60.29 -43.4 96.29 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.861 173.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.568 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 76.3 t -55.3 -35.99 38.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.905 177.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.654 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 16.2 t70 -71.63 -22.33 61.71 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 120.504 0.193 . . . . 0.0 111.447 -179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.56 ' O ' HG23 ' A' ' 975' ' ' VAL . 7.2 mm-40 -70.06 -47.87 60.18 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 122.838 1.304 . . . . 0.0 108.379 170.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.625 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.7 t -67.83 -25.44 65.56 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.657 -1.611 . . . . 0.0 111.67 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.631 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.6 mt -63.16 -51.34 70.38 Favored Pre-proline 0 C--O 1.218 -0.579 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -177.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.654 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.6 Cg_endo -57.48 -29.42 84.64 Favored 'Trans proline' 0 C--N 1.352 0.762 0 CA-C-N 121.594 1.605 . . . . 0.0 110.729 169.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' 1042 ' ' ALA . 2.5 t -76.76 -11.29 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 119.899 -0.721 . . . . 0.0 110.885 175.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.631 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 4.2 tt -65.19 -56.08 22.22 Favored Pre-proline 0 N--CA 1.464 0.249 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.796 176.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' A' ' 976' ' ' LEU . 31.5 Cg_exo -60.5 -31.99 93.11 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 121.297 1.331 . . . . 0.0 110.628 174.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -61.05 -53.06 61.82 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.315 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.779 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.3 m -169.33 -38.32 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.699 HG22 ' HB ' ' A' ' 984' ' ' ILE . 5.5 m -57.04 -17.42 10.07 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -171.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.593 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 13.7 p-80 -48.6 -18.84 0.28 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -77.62 -54.89 5.85 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.059 177.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.056 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.8 OUTLIER -79.84 -44.21 20.93 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.315 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.699 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -59.25 -33.33 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -173.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.37 -36.05 68.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.661 174.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptm -67.34 -56.24 10.55 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.78 -176.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.576 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -81.66 -39.94 23.61 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -173.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 1.071 ' HA ' HD12 ' A' ' 991' ' ' LEU . 25.0 tm0? -67.47 -38.99 85.26 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.848 -0.741 . . . . 0.0 110.688 -173.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -72.5 -24.67 61.19 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.479 0.657 . . . . 0.0 109.268 175.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.4 tp -72.79 -41.13 65.3 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.561 176.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.071 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.5 mt -59.01 -50.51 73.82 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.216 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.42 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 27.9 t-20 -55.5 -38.83 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.564 -0.743 . . . . 0.0 109.818 -178.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -67.51 -38.77 84.79 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.408 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.703 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -113.31 -30.13 7.01 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -170.669 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.082 ' HA ' HD12 ' A' 1028 ' ' LEU . 4.2 mm? -55.95 -51.16 68.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 166.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.767 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -60.65 -44.33 96.54 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.582 174.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.597 ' HG3' ' HE2' ' A' 1001 ' ' LYS . 6.3 tp10 -51.97 -42.93 63.29 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.983 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.695 ' O ' ' HG2' ' A' 1002 ' ' MET . 3.8 mm? -70.94 -33.1 70.17 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.568 -175.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.777 ' HA ' HG11 ' A' ' 955' ' ' VAL . 8.2 pt -62.65 -23.57 33.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.095 177.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.745 ' O ' ' HB2' ' A' 1004 ' ' LEU . 17.0 m-80 -94.52 -10.3 32.64 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.262 176.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.597 ' HE2' ' HG3' ' A' ' 997' ' ' GLU . 73.0 mmtt -83.36 -40.14 19.81 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.053 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 8.6 mmt -70.81 -44.2 67.06 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.732 ' O ' ' HB2' ' A' 1007 ' ' GLN . 86.2 tttt -57.62 -45.69 85.07 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.464 173.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.745 ' HB2' ' O ' ' A' 1000 ' ' ASN . 17.0 tp -55.09 -53.53 54.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.454 0.702 . . . . 0.0 112.824 172.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.25 -41.74 93.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.077 0.465 . . . . 0.0 110.58 -179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.6 pp0? -76.06 -18.05 59.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.555 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.732 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.4 tp-100 -75.94 -41.03 52.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.362 178.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.59 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 0.9 OUTLIER -71.04 -54.6 10.6 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.354 176.527 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.405 ' O ' HG13 ' A' 1009 ' ' VAL . 9.1 p 34.15 78.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 O-C-N 124.679 1.237 . . . . 0.0 113.053 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.569 ' H ' ' HB2' ' A' 1014 ' ' GLN . 22.8 ttt -135.65 124.31 23.76 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 176.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.2 t -39.2 -49.41 1.86 Allowed 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -166.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 7.9 t -99.69 -35.66 9.74 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 121.703 -0.623 . . . . 0.0 111.608 -177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.09 -9.81 57.52 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -171.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.574 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? -64.01 -30.93 71.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.795 0.331 . . . . 0.0 110.121 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.577 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 1.6 mp0 -61.7 -33.37 73.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.765 -176.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.73 -47.75 50.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.682 0.277 . . . . 0.0 111.232 169.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.625 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.9 m-30 -76.12 -22.09 55.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.195 0.521 . . . . 0.0 110.508 178.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.685 ' HG3' ' OH ' ' A' ' 951' ' ' TYR . 75.7 tttt -73.03 -41.81 63.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.164 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 22.2 tptm -72.84 -18.64 61.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.962 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -77.24 -40.57 44.33 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' SD ' ' A' 1002 ' ' MET . 1.5 tmt? -66.04 -38.83 89.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.869 174.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 7.6 tt -55.38 -50.8 68.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.895 0.379 . . . . 0.0 110.405 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 13.1 m -67.62 -34.64 77.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.486 0.66 . . . . 0.0 110.808 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.565 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -74.36 -37.49 63.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.097 -176.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -66.26 -32.04 73.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.649 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' 1030 ' ' VAL . 12.0 t-80 -66.67 -32.49 73.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 175.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -67.4 -50.97 57.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.923 177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.082 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -67.4 -30.7 70.53 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.261 0.553 . . . . 0.0 110.304 -178.168 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.647 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.52 -41.41 76.67 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.853 170.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' 1026 ' ' HIS . 88.8 t -66.67 -31.12 52.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.649 177.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.703 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 5.8 m-20 -59.07 -47.48 85.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.046 0.45 . . . . 0.0 109.961 176.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.12 87.19 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.567 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.759 ' O ' ' HG ' ' A' 1036 ' ' LEU . 31.0 mmmt -63.31 -36.63 84.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.123 0.487 . . . . 0.0 111.358 -178.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.649 ' O ' HG23 ' A' 1038 ' ' VAL . 2.3 t30 -68.71 -39.67 80.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.381 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 991' ' ' LEU . 12.1 tp -78.86 -22.23 46.35 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.866 -177.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.778 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -67.95 -31.59 71.44 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' 1041 ' ' GLN . 28.3 t70 -75.89 -31.89 59.41 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.512 171.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.056 HG13 ' HB3' ' A' ' 983' ' ' GLU . 33.9 t -64.04 -67.31 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.297 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.749 HG12 ' O ' ' A' 1035 ' ' LEU . 7.7 pt -80.99 -32.23 12.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.061 -170.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.573 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 12.6 t0 -55.11 -45.93 75.52 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 166.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.65 ' HB2' ' O ' ' A' 1037 ' ' ASP . 2.7 mp0 -67.86 -28.65 67.72 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.147 176.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.63 ' O ' HG11 ' A' ' 975' ' ' VAL . . . -52.81 -53.18 52.13 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-O 120.861 0.362 . . . . 0.0 111.063 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.453 ' HB3' ' HG3' ' A' ' 920' ' ' ARG . 0.9 OUTLIER -54.21 -36.6 63.64 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.008 176.052 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.871 ' HB2' ' HD3' ' A' ' 920' ' ' ARG . 14.6 tp -76.81 -25.25 53.07 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.982 -0.449 . . . . 0.0 111.539 173.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.779 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 25.0 mmtp -63.21 -21.39 66.19 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 172.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' 1043 ' ' ARG . 11.9 tmm? -74.89 -43.91 51.77 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.728 -1.123 . . . . 0.0 108.913 176.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.734 HG23 ' HA ' ' A' 1052 ' ' PRO . 3.9 mp -61.31 -41.57 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-O 121.609 0.719 . . . . 0.0 109.868 170.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.519 ' HB2' ' HA ' ' A' 1045 ' ' LYS . 32.8 m -69.35 -12.73 61.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.617 -1.174 . . . . 0.0 111.093 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -72.44 -69.39 0.41 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 175.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 7.1 t -176.35 29.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.912 0.387 . . . . 0.0 110.733 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' 1047 ' ' ILE . 71.5 ttt180 -144.87 97.96 4.86 Favored Pre-proline 0 C--N 1.324 -0.501 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.085 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.734 ' HA ' HG23 ' A' 1047 ' ' ILE . 17.4 Cg_exo -68.21 -26.9 35.62 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.753 2.302 . . . . 0.0 111.645 176.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 18.7 t-80 . . . . . 0 C--O 1.245 0.868 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.36 179.939 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.564 ' HG3' ' HB3' ' A' 1043 ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 120.964 0.411 . . . . 0.0 110.17 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 17.7 p -91.31 25.38 2.58 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.551 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.559 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.28 54.71 7.02 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.218 -175.553 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.48 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -47.01 -173.27 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 O-C-N 125.763 1.914 . . . . 0.0 112.084 -176.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.597 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.0 tmtm? -39.01 -22.74 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 123.385 0.674 . . . . 0.0 111.685 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 1.022 ' HA ' HG23 ' A' ' 968' ' ' THR . 14.8 m -56.64 -52.82 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.599 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.437 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 12.9 t80 -77.91 -32.99 52.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 -175.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 930' ' ' THR . 3.3 tt0 -61.19 -58.57 7.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 113.208 -1.815 . . . . 0.0 112.102 -174.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -71.99 -32.27 67.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.59 -172.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.619 ' HA ' HD12 ' A' ' 965' ' ' LEU . 39.9 t -63.33 -35.09 70.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.092 173.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.533 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -65.33 -39.05 91.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 169.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.07 -29.75 62.85 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.935 175.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.82 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 22.5 tp -65.39 -38.79 91.03 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.479 ' HA ' HG12 ' A' ' 936' ' ' VAL . 38.2 t -67.66 -40.89 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.13 174.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -61.8 -30.6 70.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.159 0.504 . . . . 0.0 110.107 177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.6 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -76.65 -26.33 54.72 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.354 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.0 p -85.04 -4.97 9.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.899 0.857 . . . . 0.0 109.092 172.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 62.4 mt -81.46 -38.63 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 163.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 73.0 mm-40 -52.77 -40.28 63.0 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.364 167.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.705 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.26 -44.93 92.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.839 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.619 ' O ' HG22 ' A' ' 943' ' ' ILE . 5.0 p -74.57 -27.36 60.46 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -178.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.455 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.4 p -79.13 -44.98 20.93 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.694 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 0.1 OUTLIER -51.35 -43.53 61.83 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 113.304 -1.771 . . . . 0.0 110.889 172.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 940' ' ' SER . 0.3 OUTLIER -67.54 -29.37 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 O-C-N 123.841 0.713 . . . . 0.0 110.746 -175.498 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.821 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.8 mm-40 -52.01 -58.58 10.81 Favored Pre-proline 0 CA--C 1.534 0.337 0 CA-C-O 119.398 -0.334 . . . . 0.0 111.555 -178.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.821 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 56.6 Cg_endo -101.25 26.22 0.13 Allowed 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 121.884 1.723 . . . . 0.0 113.166 175.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.694 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -83.86 121.87 76.1 Favored Pre-proline 0 C--N 1.33 -0.249 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -174.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.768 ' HD2' ' HG3' ' A' ' 950' ' ' GLU . 92.7 Cg_endo -82.04 -176.2 2.89 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.814 2.343 . . . . 0.0 109.568 156.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.958 ' HA ' ' HD2' ' A' ' 951' ' ' TYR . 8.9 Cg_endo -51.71 -41.15 63.29 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.456 2.104 . . . . 0.0 112.743 177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -64.69 -7.41 10.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.054 -0.976 . . . . 0.0 112.021 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.768 ' HG3' ' HD2' ' A' ' 947' ' ' PRO . 5.9 mm-40 -109.46 -17.09 13.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.261 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.958 ' HD2' ' HA ' ' A' ' 948' ' ' PRO . 31.8 m-85 -59.42 -37.3 77.7 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.058 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.41 -50.41 2.77 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.621 177.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.058 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.1 Cg_exo -56.31 -36.74 97.36 Favored 'Trans proline' 0 C--N 1.36 1.146 0 C-N-CA 122.727 2.284 . . . . 0.0 114.854 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.705 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 20.6 ptp -60.14 -47.52 85.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.747 0.784 . . . . 0.0 108.973 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.692 ' HB ' ' HB3' ' A' 1002 ' ' MET . 61.8 t -65.22 -28.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.334 172.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 22.0 tptm -62.06 -37.34 84.63 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 177.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.484 ' HG3' ' HB3' ' A' ' 938' ' ' GLU . 71.1 mm-40 -55.74 -47.14 77.44 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.608 174.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 1.004 HG21 HD23 ' A' ' 998' ' ' LEU . 3.6 m -72.47 -28.88 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.791 177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.579 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -73.39 -44.92 32.12 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.063 -1.065 . . . . 0.0 111.783 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.65 -31.72 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.82 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -60.41 -55.23 36.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.531 178.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.675 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 4.6 tt -65.34 -32.77 74.58 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.327 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.485 ' HA ' ' HD3' ' A' ' 963' ' ' ARG . 30.8 mmt180 -65.02 -48.64 73.19 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 122.009 -0.432 . . . . 0.0 111.583 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.451 HG22 ' OD1' ' A' ' 928' ' ' ASN . 11.1 m -60.04 -37.46 79.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.358 0.599 . . . . 0.0 109.937 172.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 3.2 tt -59.03 -30.43 68.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.49 173.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.523 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 52.5 tp -66.6 -31.44 72.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 970' ' ' ASP . . . -65.65 -41.45 92.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.942 0.877 . . . . 0.0 109.658 173.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 1.022 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -60.96 -38.6 86.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.742 171.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 70.7 t -55.4 -30.79 26.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.001 171.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.656 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.7 t70 -65.45 -29.59 70.28 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 122.406 -0.184 . . . . 0.0 111.313 177.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.614 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 54.2 mm-40 -65.95 -52.11 52.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 122.293 1.044 . . . . 0.0 109.658 172.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.531 ' HB3' ' CG1' ' A' 1039 ' ' ILE . 60.7 p -66.35 -23.3 66.32 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.153 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.857 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 65.1 tp -58.66 -54.72 53.39 Favored Pre-proline 0 C--O 1.217 -0.606 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -175.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.656 ' HD3' ' O ' ' A' ' 970' ' ' ASP . 26.1 Cg_exo -64.86 -25.55 60.18 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.397 1.535 . . . . 0.0 110.319 172.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 971' ' ' GLU . 5.3 t -75.6 -16.37 15.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 119.909 -0.717 . . . . 0.0 111.5 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.857 ' HG ' ' O ' ' A' ' 973' ' ' LEU . 4.6 pp -80.45 -38.48 1.09 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 118.344 -0.836 . . . . 0.0 113.001 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.734 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 21.9 Cg_exo -66.34 -26.63 48.28 Favored 'Trans proline' 0 C--N 1.36 1.132 0 CA-C-N 121.578 1.599 . . . . 0.0 110.0 171.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.664 ' HB1' ' HG3' ' A' 1049 ' ' GLN . . . -69.84 -51.82 30.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.266 173.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 25.8 m -162.57 -48.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.962 HG22 ' HB ' ' A' ' 984' ' ' ILE . 51.4 m -46.92 -20.45 0.14 Allowed 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 115.441 1.645 . . . . 0.0 115.441 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.653 ' HB2' ' O ' ' A' ' 976' ' ' LEU . 19.5 t-80 -51.72 -20.15 1.97 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -76.81 -54.45 6.6 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.941 -177.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.077 ' HB2' HG22 ' A' 1038 ' ' VAL . 7.9 pm0 -78.64 -37.39 42.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 121.813 -0.554 . . . . 0.0 111.839 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.962 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.8 tp -62.03 -21.88 27.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -72.45 -47.13 51.37 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.059 173.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.487 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 22.7 ptp -72.26 -46.26 56.63 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.768 -170.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.65 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.73 -45.55 20.95 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -175.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.98 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.9 tt0 -62.21 -43.68 98.29 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.178 -175.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.445 ' NZ ' ' HB3' ' A' ' 989' ' ' LYS . 9.8 mtpm? -66.63 -32.61 74.05 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.415 0.626 . . . . 0.0 109.474 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.861 HD23 HD22 ' A' 1034 ' ' ASN . 3.3 tp -65.13 -43.72 91.01 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.378 177.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.05 HD23 ' HB3' ' A' 1031 ' ' ASP . 22.8 mt -60.0 -45.98 90.98 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.01 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -54.94 -41.55 71.2 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.654 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.1 m -73.04 -34.37 66.27 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.256 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.686 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 0.8 OUTLIER -103.97 -31.67 9.62 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -170.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.857 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -57.93 -38.46 75.96 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 165.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -55.57 -48.98 73.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.685 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -65.75 -32.31 73.79 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.718 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 1.004 HD23 HG21 ' A' ' 958' ' ' VAL . 14.1 tp -71.34 -26.78 62.97 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 119.11 -1.036 . . . . 0.0 108.898 178.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HG2' ' A' 1002 ' ' MET . 64.4 mt -62.36 -27.14 42.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.375 0.607 . . . . 0.0 109.605 169.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.681 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 77.5 m-20 -80.68 -6.71 58.77 Favored 'General case' 0 C--O 1.209 -1.039 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 174.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.665 ' HA ' ' HG3' ' A' 1021 ' ' MET . 58.2 tttm -80.07 -45.24 18.62 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 172.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.893 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 17.7 ptp -64.34 -38.0 89.47 Favored 'General case' 0 CA--C 1.505 -0.766 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 175.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.822 ' O ' ' HB2' ' A' 1007 ' ' GLN . 54.6 tttp -67.87 -61.94 1.64 Allowed 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.516 -1.22 . . . . 0.0 109.712 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.648 ' HB2' ' O ' ' A' 1000 ' ' ASN . 4.8 tp -56.49 -56.08 25.72 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -173.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.6 -46.62 83.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.16 0.505 . . . . 0.0 110.785 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -76.15 -24.14 54.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.952 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.822 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.0 OUTLIER -69.07 -46.08 68.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.825 -173.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.63 ' HB2' ' CE2' ' A' 1017 ' ' TYR . 0.0 OUTLIER -121.81 32.92 5.67 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.989 -0.684 . . . . 0.0 111.256 175.681 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.613 HG21 ' HB3' ' A' ' 948' ' ' PRO . 7.2 p -46.78 122.81 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.567 0.699 . . . . 0.0 110.991 173.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.88 ' H ' ' HB2' ' A' 1014 ' ' GLN . 0.4 OUTLIER -153.97 147.55 25.15 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 -177.265 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 11.9 t -61.11 -6.87 2.2 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -173.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 46.7 t -135.32 -47.21 0.7 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.869 0.366 . . . . 0.0 111.222 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 7.5 mp -73.04 -20.71 60.93 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.88 ' HB2' ' H ' ' A' 1010 ' ' MET . 0.8 OUTLIER -56.77 -42.62 79.7 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.061 0.226 . . . . 0.0 111.498 -173.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -52.82 -38.27 61.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -165.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -47.19 -51.56 18.15 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.079 0.466 . . . . 0.0 111.684 171.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.641 ' HA ' HD23 ' A' 1004 ' ' LEU . 3.2 m-85 -68.33 -23.87 64.76 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.968 0.889 . . . . 0.0 109.204 -173.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.702 ' HB2' HE22 ' A' 1014 ' ' GLN . 85.3 tttt -79.41 -41.66 27.17 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.05 176.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 79.0 tttt -77.96 -33.76 51.38 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.59 0.71 . . . . 0.0 111.643 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -82.01 -45.74 14.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.276 -0.874 . . . . 0.0 108.9 -171.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.665 ' HG3' ' HA ' ' A' 1001 ' ' LYS . 25.8 mmt -75.37 -17.74 60.14 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.824 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.456 ' HB2' ' O ' ' A' 1018 ' ' LYS . 58.8 tp -63.45 -43.53 97.13 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 171.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.3 m -61.62 -28.65 69.52 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.3 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.82 -30.92 51.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.742 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -67.45 -40.61 85.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.327 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.534 ' O ' HG23 ' A' 1030 ' ' VAL . 14.8 t-80 -58.39 -38.02 76.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.103 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -65.0 -49.54 69.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.857 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -68.3 -29.05 67.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.34 0.59 . . . . 0.0 110.07 -177.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.498 ' N ' HD23 ' A' 1028 ' ' LEU . . . -59.75 -42.68 93.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.604 172.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' 1026 ' ' HIS . 47.7 t -67.03 -31.4 53.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.957 174.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 1.05 ' HB3' HD23 ' A' ' 991' ' ' LEU . 2.4 m-20 -56.19 -46.93 79.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.665 173.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.79 -53.53 57.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.313 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -54.1 -42.0 68.89 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.905 0.384 . . . . 0.0 111.646 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.861 HD22 HD23 ' A' ' 990' ' ' LEU . 50.6 t30 -63.72 -49.83 71.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.823 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.915 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -73.13 -27.57 61.75 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -176.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.468 ' N ' HG11 ' A' ' 929' ' ' VAL . 4.4 tt -57.5 -35.86 70.77 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.527 0.731 . . . . 0.0 110.737 177.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 25.6 t70 -92.51 -33.68 14.37 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.077 HG22 ' HB2' ' A' ' 983' ' ' GLU . 2.0 t -56.09 -46.57 80.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.367 175.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.588 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.2 tt -93.48 -28.51 4.38 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.938 -172.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 7.5 t70 -57.33 -42.81 82.61 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 161.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 15.2 mm100 -69.81 -31.44 69.35 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.707 174.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.588 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.82 -56.11 20.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.05 0.452 . . . . 0.0 110.553 171.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.737 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.2 tpt180 -57.29 -33.86 68.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.618 177.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.462 HD13 HH11 ' A' ' 920' ' ' ARG . 63.3 tp -69.01 -41.82 77.25 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 121.094 -0.243 . . . . 0.0 111.066 172.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.891 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 42.1 mmtm -51.09 -37.39 45.51 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 122.029 0.919 . . . . 0.0 110.079 174.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.435 ' HB2' ' CG1' ' A' ' 975' ' ' VAL . 28.0 ttt -68.82 -38.06 79.61 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.271 -1.331 . . . . 0.0 110.017 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.71 HG22 ' HG3' ' A' 1052 ' ' PRO . 42.8 mm -67.56 -36.3 75.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.38 173.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' 1045 ' ' LYS . 71.0 m -56.15 -51.39 68.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.305 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.664 ' HG3' ' HB1' ' A' ' 978' ' ' ALA . 15.8 mm100 -65.88 -30.14 70.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.219 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 22.0 m -79.51 -14.54 58.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.526 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.403 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 10.5 tpt180 66.03 106.44 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.498 -177.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.71 ' HG3' HG22 ' A' 1047 ' ' ILE . 5.8 Cg_exo -77.24 -82.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.637 2.224 . . . . 0.0 111.339 177.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 29.6 m170 . . . . . 0 C--O 1.243 0.73 0 CA-C-O 118.389 -0.815 . . . . 0.0 109.212 174.517 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.73 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.624 0.25 . . . . 0.0 110.791 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.623 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 28.4 t -68.89 139.09 55.13 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 166.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.657 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.1 OUTLIER -72.02 67.91 0.66 Allowed 'General case' 0 CA--C 1.499 -1.002 0 C-N-CA 122.538 0.335 . . . . 0.0 111.524 -173.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.507 ' O ' ' N ' ' A' ' 925' ' ' VAL . 8.2 t70 -47.87 -173.92 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 O-C-N 125.902 2.001 . . . . 0.0 112.325 -173.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.549 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 5.1 tmtp? -39.27 -19.76 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 124.042 0.937 . . . . 0.0 112.508 -177.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.959 ' HA ' HG23 ' A' ' 968' ' ' THR . 3.7 m -62.01 -57.16 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 123.037 0.535 . . . . 0.0 112.193 174.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 23.3 t80 -78.97 -31.28 44.87 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 122.206 1.003 . . . . 0.0 108.764 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.549 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 7.8 mm-40 -60.84 -59.49 5.3 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 113.953 -1.476 . . . . 0.0 112.188 -175.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.52 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 5.1 t30 -73.65 -32.54 64.05 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.671 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.828 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.7 p -62.63 -37.11 78.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 119.904 -0.719 . . . . 0.0 110.423 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.529 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 31.0 m -66.65 -33.94 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.291 0.567 . . . . 0.0 109.586 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.27 -31.07 65.29 Favored Glycine 0 CA--C 1.521 0.465 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.381 173.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.718 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 25.9 tp -62.99 -41.78 99.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.004 0.43 . . . . 0.0 109.886 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 937' ' ' ILE . 48.2 t -62.3 -43.02 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 0.0 110.011 174.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -55.95 -40.89 73.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.724 177.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.36 -31.63 62.47 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.864 -177.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.627 ' HA ' HG22 ' A' ' 958' ' ' VAL . 13.0 p -77.41 -16.8 14.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 119.756 -0.778 . . . . 0.0 109.441 174.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.5 mm -72.55 -42.46 63.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 165.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 45.1 mt-10 -54.44 -37.2 64.87 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.937 172.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.553 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 42.9 ttp -57.94 -45.86 85.94 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.626 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.5 t -72.48 -32.84 66.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.857 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 24.0 m -77.64 -47.01 20.33 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.999 0.905 . . . . 0.0 109.968 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.563 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -78.86 -15.94 57.72 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.477 -174.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.855 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 6.8 tt -78.99 -25.62 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.106 172.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.699 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 30.2 mm-40 -50.93 -53.72 44.81 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.1 Cg_endo -104.43 36.26 0.05 OUTLIER 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.09 1.86 . . . . 0.0 114.319 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.726 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -138.16 155.53 74.26 Favored Pre-proline 0 N--CA 1.466 0.33 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -176.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.528 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 50.5 Cg_endo -90.47 -176.72 1.1 Allowed 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 124.043 3.162 . . . . 0.0 112.091 176.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.765 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 77.8 Cg_exo -51.96 -31.77 44.99 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.976 2.451 . . . . 0.0 113.086 178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.421 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 47.1 mt-10 -53.99 -36.17 62.63 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.557 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.726 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 2.4 mp0 -98.65 0.09 44.03 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.765 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 15.8 m-30 -61.27 -41.21 96.55 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.0 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -75.02 -51.25 3.64 Favored Pre-proline 0 CA--C 1.557 1.212 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.729 176.05 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.991 ' HD3' HG13 ' A' ' 952' ' ' VAL . 79.9 Cg_exo -51.54 -33.74 49.19 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.408 2.072 . . . . 0.0 115.112 173.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.855 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 27.3 ptt? -67.48 -45.84 74.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.182 0.515 . . . . 0.0 109.997 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.691 HG13 ' HG ' ' A' ' 998' ' ' LEU . 87.2 t -64.67 -27.14 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.502 173.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.7 ttpm? -59.4 -37.02 76.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -54.69 -46.09 74.05 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.882 175.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.627 HG22 ' HA ' ' A' ' 936' ' ' VAL . 2.1 t -69.95 -36.23 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.851 176.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.639 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.02 -44.46 67.16 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.358 -0.925 . . . . 0.0 112.872 -176.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.21 -32.34 72.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.884 0.374 . . . . 0.0 110.486 171.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.718 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.19 -55.92 21.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.616 176.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 1.8 tm? -63.8 -35.03 79.27 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.527 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -57.42 -57.38 12.93 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 121.827 -0.546 . . . . 0.0 111.114 171.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -55.81 -31.07 62.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.367 0.603 . . . . 0.0 110.65 175.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' 1035 ' ' LEU . 2.5 tm? -65.56 -39.87 92.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.057 176.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.5 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 8.6 tt -54.75 -33.53 61.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.043 176.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.01 -43.25 79.27 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.308 0.575 . . . . 0.0 110.317 174.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.959 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.4 m -56.03 -40.75 73.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.837 170.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.667 HG13 HD11 ' A' ' 984' ' ' ILE . 79.1 t -54.2 -32.0 22.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.681 173.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.779 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 24.9 t70 -68.06 -32.37 72.66 Favored 'General case' 0 C--O 1.219 -0.506 0 O-C-N 122.472 -0.143 . . . . 0.0 111.01 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.63 -53.0 63.13 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-O 122.78 1.276 . . . . 0.0 108.575 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.577 ' OG ' HG21 ' A' ' 980' ' ' THR . 26.7 t -65.42 -22.35 66.76 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.106 -1.406 . . . . 0.0 112.176 178.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.643 ' O ' ' HD3' ' A' ' 977' ' ' PRO . 6.4 tt -59.73 -54.96 50.57 Favored Pre-proline 0 CA--C 1.542 0.648 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.916 -177.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.779 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.8 Cg_endo -58.84 -22.42 62.18 Favored 'Trans proline' 0 C--N 1.357 1.007 0 CA-C-N 121.58 1.6 . . . . 0.0 111.133 170.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.587 HG12 ' HB ' ' A' ' 980' ' ' THR . 60.0 t -74.35 -16.44 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.038 173.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 1.002 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.4 pp -75.19 -41.37 3.91 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-O 118.42 -0.8 . . . . 0.0 112.409 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 1.002 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 23.7 Cg_exo -65.69 -27.07 52.91 Favored 'Trans proline' 0 C--N 1.361 1.219 0 CA-C-N 120.957 1.378 . . . . 0.0 110.354 171.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.06 -60.49 2.98 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.775 172.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.565 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 37.4 m -166.56 -34.2 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.817 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 1.5 t -63.38 -15.71 58.31 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -167.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.676 ' HA ' HG22 ' A' ' 984' ' ' ILE . 81.3 t60 -49.38 -21.03 0.78 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -71.29 -53.59 13.74 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.019 -0.673 . . . . 0.0 110.732 176.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.095 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -76.75 -42.69 40.1 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.676 HG22 ' HA ' ' A' ' 981' ' ' HIS . 11.3 tp -59.38 -28.54 39.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.892 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -73.53 -40.95 63.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.533 174.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.4 ptp -64.87 -57.48 8.72 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.286 -0.566 . . . . 0.0 112.055 -172.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.16 -42.04 27.08 Favored 'General case' 0 C--O 1.206 -1.201 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -174.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.974 ' HA ' HD12 ' A' ' 991' ' ' LEU . 41.6 tt0 -57.35 -42.91 82.92 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 119.951 -0.7 . . . . 0.0 111.213 -175.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -68.62 -31.02 69.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.366 0.603 . . . . 0.0 109.512 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.793 ' HG ' ' CG ' ' A' 1031 ' ' ASP . 3.1 tp -75.42 -31.81 60.5 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.673 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.974 HD12 ' HA ' ' A' ' 988' ' ' GLN . 44.1 mt -64.71 -49.79 69.49 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.229 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -58.24 -40.39 81.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.535 -177.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 20.2 m -76.98 -35.33 57.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.465 -176.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.96 -31.48 12.15 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -172.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.052 ' HA ' HD22 ' A' 1028 ' ' LEU . 1.8 tm? -56.43 -37.64 70.5 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 162.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.564 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -60.42 -48.01 83.63 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.89 176.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.479 ' O ' ' HD3' ' A' 1001 ' ' LYS . 18.5 mt-10 -59.47 -37.09 77.31 Favored 'General case' 0 CA--C 1.504 -0.797 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.712 176.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.691 ' HG ' HG13 ' A' ' 955' ' ' VAL . 24.2 tp -68.63 -33.42 73.98 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.658 -178.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.594 ' O ' ' HG2' ' A' 1002 ' ' MET . 33.8 pt -79.26 -25.24 12.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.911 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.516 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.4 m-80 -79.73 -17.06 54.43 Favored 'General case' 0 C--O 1.211 -0.968 0 O-C-N 122.219 -0.3 . . . . 0.0 110.349 167.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.69 ' CG ' ' HA ' ' A' 1021 ' ' MET . 0.3 OUTLIER -86.49 -31.71 21.17 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 121.113 -0.235 . . . . 0.0 110.619 178.342 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.0 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -69.18 -36.28 77.17 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 167.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.776 ' O ' ' HB2' ' A' 1007 ' ' GLN . 59.9 tttp -62.44 -56.14 20.99 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.921 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' 1000 ' ' ASN . 29.1 mt -58.88 -43.86 91.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 178.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.33 -46.78 85.56 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.134 0.492 . . . . 0.0 110.23 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.24 -19.2 56.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.16 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.776 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -76.21 -44.82 36.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.453 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.52 ' O ' ' HG3' ' A' 1010 ' ' MET . 0.0 OUTLIER -71.77 -61.49 1.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.702 176.311 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.551 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 14.2 p 35.39 59.23 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.107 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.675 ' H ' ' HB2' ' A' 1014 ' ' GLN . 67.5 mtt -122.53 42.64 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.897 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' 1014 ' ' GLN . 10.4 m 56.66 -94.6 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 176.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.9 m -82.4 -31.02 29.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.913 0.387 . . . . 0.0 110.391 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' 1010 ' ' MET . 99.4 mt -72.14 -27.08 62.37 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 173.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.675 ' HB2' ' H ' ' A' 1010 ' ' MET . 1.2 tm0? -64.49 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.813 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -54.98 -43.76 73.81 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.2 tt0 -50.27 -43.82 53.45 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.443 174.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.422 ' CE2' HD22 ' A' 1004 ' ' LEU . 2.1 m-30 -77.97 -23.4 48.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.547 0.213 . . . . 0.0 110.681 -179.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.588 ' HB2' HE22 ' A' 1014 ' ' GLN . 39.3 ttpt -65.76 -37.0 85.16 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -71.29 -48.97 47.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.2 176.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' 1016 ' ' GLU . 70.7 mm-40 -52.13 -37.45 54.37 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.156 0.503 . . . . 0.0 110.564 172.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.69 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 51.8 ttp -63.52 -50.21 70.47 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.75 176.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' 1018 ' ' LYS . 98.0 mt -61.9 -28.78 69.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.866 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 37.8 m -66.44 -36.73 83.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.489 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.57 -40.03 35.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.022 -0.536 . . . . 0.0 109.577 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -56.82 -42.7 80.05 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.237 176.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' 1030 ' ' VAL . 13.9 t60 -54.79 -51.59 65.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.441 176.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.46 93.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.632 -176.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.052 HD22 ' HA ' ' A' ' 995' ' ' LEU . 12.3 tp -73.39 -42.6 61.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.218 -178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.25 84.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 177.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' 1026 ' ' HIS . 54.7 t -67.03 -42.02 88.01 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.335 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.793 ' CG ' ' HG ' ' A' ' 990' ' ' LEU . 25.4 t0 -66.04 -32.29 73.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 176.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.12 -44.97 71.78 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 167.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.688 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 41.6 mtpt -70.84 -23.08 62.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.932 174.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.558 ' O ' HG23 ' A' 1038 ' ' VAL . 48.9 t30 -74.0 -43.79 56.8 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.781 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tp -79.85 -21.51 44.04 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.136 -179.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.828 ' HA ' HG11 ' A' ' 929' ' ' VAL . 2.7 pp -72.08 -22.03 61.42 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.575 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.3 t70 -81.15 -48.08 12.6 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.506 168.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.095 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.4 t -47.89 -61.69 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.444 176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.712 HG12 ' HB ' ' A' ' 925' ' ' VAL . 8.7 tt -89.75 -25.47 5.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.064 0 CA-C-N 114.351 -1.295 . . . . 0.0 112.061 -167.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.855 ' O ' ' HG3' ' A' 1043 ' ' ARG . 18.5 t70 -63.34 -33.36 75.35 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 118.983 -1.087 . . . . 0.0 109.032 162.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' 1037 ' ' ASP . 60.6 mt-30 -76.61 -26.86 55.42 Favored 'General case' 0 C--O 1.202 -1.407 0 C-N-CA 118.735 -1.186 . . . . 0.0 109.149 171.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.659 ' HA ' ' HB2' ' A' 1045 ' ' LYS . . . -55.01 -50.31 69.36 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 117.913 0.324 . . . . 0.0 110.581 171.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.855 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -53.39 -41.33 65.81 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.815 178.671 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.622 ' N ' ' HD2' ' A' 1043 ' ' ARG . 31.8 tp -79.85 -29.82 40.17 Favored 'General case' 0 C--O 1.219 -0.508 0 O-C-N 122.006 -0.434 . . . . 0.0 111.395 176.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.817 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 7.6 mptt -55.05 -46.39 75.35 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 123.811 0.844 . . . . 0.0 110.173 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 24.8 ttt -62.23 -45.01 95.26 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.715 178.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.467 ' CD1' ' HB2' ' A' ' 920' ' ' ARG . 1.7 mp -67.99 -21.48 26.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.573 176.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' 1045 ' ' LYS . 32.5 t -66.63 -36.85 83.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.829 0.347 . . . . 0.0 110.422 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -77.36 -34.68 55.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.225 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 32.5 t -88.78 -19.81 25.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.202 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 26.5 mtp180 68.48 152.95 0.13 Allowed Pre-proline 0 N--CA 1.466 0.344 0 C-N-CA 123.555 0.742 . . . . 0.0 111.932 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -72.93 -62.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.747 1.631 . . . . 0.0 109.879 165.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 11.4 p80 . . . . . 0 C--O 1.245 0.835 0 CA-C-N 115.087 -0.961 . . . . 0.0 108.748 170.162 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 1.134 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 120.729 0.3 . . . . 0.0 111.675 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.0 t -113.18 31.54 6.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.175 -175.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.472 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER 51.16 56.38 8.06 Favored 'General case' 0 CA--C 1.494 -1.199 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.125 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.5 ' O ' ' N ' ' A' ' 925' ' ' VAL . 1.3 m-20 -47.26 -173.17 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 O-C-N 126.101 2.125 . . . . 0.0 112.932 -174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.8 tmtm? -40.27 -17.38 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.453 -178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.727 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -63.63 -53.23 47.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.767 174.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -77.55 -29.92 52.46 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 -178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 46.5 mt-10 -61.07 -60.73 3.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.278 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.48 HD21 HG22 ' A' ' 964' ' ' THR . 10.4 t-20 -67.91 -41.74 82.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.247 -171.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.911 HG11 ' HA ' ' A' 1036 ' ' LEU . 14.1 p -60.09 -37.8 74.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.255 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.423 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 28.1 m -68.59 -31.17 70.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.099 0.476 . . . . 0.0 110.069 173.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.56 -32.21 68.54 Favored Glycine 0 CA--C 1.521 0.463 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.149 172.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.988 HD12 ' HB2' ' A' 1032 ' ' ALA . 3.4 tm? -61.54 -45.48 93.98 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.3 t -58.86 -42.71 86.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.209 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.512 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.0 mmtp -67.14 -21.61 65.82 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.365 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.16 -31.61 44.05 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.757 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . . . . . . . . . 14.0 p -82.98 -13.91 11.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 119.679 -0.809 . . . . 0.0 109.04 172.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 933' ' ' VAL . 45.9 mm -68.21 -43.04 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 164.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 6.4 mm-40 -54.05 -45.17 71.58 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.298 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.805 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.0 tmt? -57.59 -42.18 82.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.251 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.537 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 24.2 m -69.04 -30.51 68.88 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.104 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.599 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 16.7 m -78.33 -43.14 28.58 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.3 mmtp -56.16 -42.08 76.46 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 113.335 -1.757 . . . . 0.0 111.759 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.747 HD11 ' HE2' ' A' 1018 ' ' LYS . 13.9 tt -73.82 -23.26 18.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.05 -177.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.776 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 34.4 mm-40 -53.67 -62.75 3.26 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.776 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.2 Cg_endo -99.95 -4.0 0.61 Allowed 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 121.545 1.496 . . . . 0.0 114.515 -175.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.638 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -114.15 150.19 43.22 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -170.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 3.4 Cg_exo -82.84 -178.56 3.95 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 124.223 3.282 . . . . 0.0 112.961 -178.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.725 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 85.7 Cg_exo -50.03 -33.16 33.65 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 123.624 2.883 . . . . 0.0 114.269 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -54.62 -29.74 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.493 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.638 ' HG3' ' HB1' ' A' ' 946' ' ' ALA . 63.9 mm-40 -97.45 -4.95 37.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.108 177.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.725 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 10.3 m-30 -56.34 -40.79 75.03 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 172.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.03 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.5 OUTLIER -77.13 -48.57 2.51 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.786 176.162 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.2 Cg_exo -52.56 -27.62 33.39 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 121.702 1.601 . . . . 0.0 114.6 172.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.805 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 19.9 ptp -74.2 -34.86 63.86 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.447 -0.901 . . . . 0.0 109.435 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.752 HG21 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -65.98 -26.76 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 120.239 -0.584 . . . . 0.0 110.745 171.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.717 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.2 tttm -53.24 -44.18 67.91 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 173.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.451 ' O ' ' HB1' ' A' ' 935' ' ' ALA . 2.9 mm-40 -55.49 -47.67 75.8 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.818 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.477 HG21 HD23 ' A' ' 998' ' ' LEU . 5.0 m -75.31 -30.77 23.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.33 -45.29 31.01 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.873 -174.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.0 mp -65.65 -27.3 68.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.81 0.338 . . . . 0.0 110.341 172.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.59 -52.78 62.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.673 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.6 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 2.8 tm? -66.53 -31.24 71.84 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.559 0.618 . . . . 0.0 110.412 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.556 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 50.6 ttm-85 -64.61 -48.07 76.27 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 121.784 -0.572 . . . . 0.0 111.074 173.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.48 HG22 HD21 ' A' ' 928' ' ' ASN . 39.7 m -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.262 0.553 . . . . 0.0 110.11 171.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.552 HD11 ' HA ' ' A' ' 929' ' ' VAL . 0.5 OUTLIER -61.3 -39.42 90.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.668 176.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 52.4 tp -52.21 -32.9 38.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.646 174.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.72 98.12 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.435 0.636 . . . . 0.0 109.783 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.727 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.7 m -62.38 -38.66 90.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.241 172.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.683 HG13 HD11 ' A' ' 984' ' ' ILE . 93.6 t -54.05 -29.57 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.028 173.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 17.7 t70 -75.92 -25.59 56.15 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.798 -0.183 . . . . 0.0 111.041 177.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -66.92 -51.97 48.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 122.39 1.09 . . . . 0.0 109.163 171.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.407 ' OG ' ' HA ' ' A' ' 969' ' ' VAL . 33.3 p -63.7 -22.48 66.93 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.918 175.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.586 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 22.1 tp -54.45 -57.21 19.72 Favored Pre-proline 0 CA--C 1.54 0.579 0 CA-C-O 118.697 -0.668 . . . . 0.0 112.221 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 20.4 Cg_endo -64.16 -20.64 67.42 Favored 'Trans proline' 0 C--N 1.363 1.325 0 CA-C-N 121.136 1.442 . . . . 0.0 111.167 173.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 1042 ' ' ALA . 54.5 t -75.17 -18.81 16.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.116 175.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.736 ' HG ' ' HD3' ' A' ' 977' ' ' PRO . 1.9 pp -74.89 -44.36 4.95 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.882 -178.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.736 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 21.7 Cg_endo -64.3 -26.95 63.71 Favored 'Trans proline' 0 C--N 1.364 1.353 0 CA-C-N 121.145 1.445 . . . . 0.0 110.64 172.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -65.37 -59.84 3.6 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.593 172.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.596 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 75.2 m -160.82 -49.01 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -176.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.716 ' HA ' ' HG2' ' A' 1045 ' ' LYS . 2.0 t -56.59 -14.35 3.11 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 -166.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.603 ' HA ' HG22 ' A' ' 984' ' ' ILE . 20.8 p-80 -51.26 -22.88 3.01 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -170.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.49 ' HA ' ' NE ' ' A' ' 982' ' ' ARG . 4.1 tpm_? -78.69 -51.18 10.19 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 110.026 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.867 ' HG3' HG22 ' A' 1038 ' ' VAL . 2.7 tp10 -73.34 -42.77 61.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.964 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.683 HD11 HG13 ' A' ' 969' ' ' VAL . 0.1 OUTLIER -55.79 -40.18 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -173.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -73.37 -31.18 63.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.792 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.626 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 12.5 ptp -63.89 -49.13 73.93 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 119.959 -0.697 . . . . 0.0 110.876 -178.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.592 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.18 -39.12 34.17 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 116.876 -0.147 . . . . 0.0 111.174 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 1.094 ' HA ' HD12 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -58.11 -47.6 82.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.799 -178.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -60.83 -35.83 77.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.543 0.687 . . . . 0.0 109.47 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.449 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.4 OUTLIER -68.25 -45.0 74.39 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.451 -1.25 . . . . 0.0 110.757 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.094 HD12 ' HA ' ' A' ' 988' ' ' GLN . 3.8 mt -58.76 -55.8 30.39 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.546 0.689 . . . . 0.0 110.507 -177.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -59.93 -33.1 71.45 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.821 -171.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 12.2 p -74.55 -38.49 62.72 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.679 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 51.3 m-20 -103.17 -28.63 11.81 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 119.803 -0.759 . . . . 0.0 112.087 -172.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.9 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.56 -42.83 93.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.217 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.613 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -64.15 -44.35 92.39 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.926 175.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.626 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 38.2 tt0 -53.41 -46.55 69.79 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.492 176.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.623 ' O ' ' HG2' ' A' 1002 ' ' MET . 28.2 tp -67.08 -38.55 85.95 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.432 -0.907 . . . . 0.0 110.898 -173.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.752 ' HA ' HG21 ' A' ' 955' ' ' VAL . 32.1 pt -61.05 -31.56 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.541 -178.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.624 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -95.32 -12.48 26.04 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.195 178.358 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.626 ' HG3' ' HG2' ' A' ' 997' ' ' GLU . 4.7 mmmm -84.74 -33.88 22.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.799 0.333 . . . . 0.0 110.453 176.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.698 ' SD ' ' HG3' ' A' 1021 ' ' MET . 72.7 mmm -74.4 -44.54 51.57 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 174.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 47.1 tttp -53.47 -44.27 68.83 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 114.265 -1.334 . . . . 0.0 109.872 167.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.717 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 18.1 tp -58.71 -49.02 79.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 175.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.687 ' HA ' ' HD2' ' A' 1017 ' ' TYR . . . -59.12 -40.28 84.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.561 0.696 . . . . 0.0 109.671 175.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.616 ' HG3' HG12 ' A' ' 952' ' ' VAL . 1.1 tm0? -64.49 -33.3 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.733 173.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -77.31 -24.36 50.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.123 -174.188 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.694 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.4 t80 -81.45 -64.28 1.22 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.603 174.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.573 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 8.0 p 37.13 40.63 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 O-C-N 124.695 1.247 . . . . 0.0 112.044 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.499 ' SD ' HD23 ' A' 1013 ' ' LEU . 53.7 ttm -80.89 9.06 6.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.83 -175.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' 1012 ' ' SER . 40.5 p 55.7 120.54 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.398 1.079 . . . . 0.0 112.839 -179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' 1011 ' ' THR . 51.4 m 73.39 -59.06 0.58 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.787 -177.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.499 HD23 ' SD ' ' A' 1010 ' ' MET . 29.2 tp -73.49 -7.79 53.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.455 0.645 . . . . 0.0 110.178 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.573 ' HG3' ' HA ' ' A' 1009 ' ' VAL . 1.1 tm0? -71.99 -17.4 62.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.51 0.672 . . . . 0.0 110.03 175.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' 1018 ' ' LYS . 12.1 tp60 -61.01 -38.47 86.2 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.528 -173.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' 1013 ' ' LEU . 6.6 pt-20 -58.53 -36.15 73.42 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.401 -0.52 . . . . 0.0 111.406 171.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 0.7 OUTLIER -70.22 -23.36 62.92 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.416 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.747 ' HE2' HD11 ' A' ' 943' ' ' ILE . 64.6 tttm -80.33 -25.05 39.49 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.564 173.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -74.71 -54.14 7.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -53.1 -32.15 45.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.657 170.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.698 ' HG3' ' SD ' ' A' 1002 ' ' MET . 33.1 ttp -57.02 -49.0 77.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.591 175.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 1.3 tm? -64.02 -49.92 70.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.949 -177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 28.2 m -60.08 -37.57 80.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.147 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -73.78 -40.07 63.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.478 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.28 -34.85 79.32 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.614 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.56 ' O ' HG23 ' A' 1030 ' ' VAL . 76.4 t60 -74.28 -38.6 63.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.52 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.62 83.95 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 173.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.9 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.0 OUTLIER -56.56 -46.04 80.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.007 176.233 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.555 ' O ' ' HG3' ' A' 1033 ' ' LYS . . . -55.67 -30.85 61.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.478 176.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 1026 ' ' HIS . 57.7 t -71.94 -33.0 46.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 176.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.679 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 1.1 m-20 -51.77 -47.71 64.05 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.505 0.669 . . . . 0.0 109.3 172.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.988 ' HB2' HD12 ' A' ' 932' ' ' LEU . . . -66.46 -48.55 69.55 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.76 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.601 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 89.1 mttt -60.6 -39.67 88.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.716 -174.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' 1038 ' ' VAL . 65.5 t30 -71.26 -36.95 71.92 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.034 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.773 HD22 HD11 ' A' ' 991' ' ' LEU . 20.4 tp -77.84 -29.4 50.5 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.544 -177.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.911 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.1 pp -68.35 -24.86 64.86 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' 1041 ' ' GLN . 38.6 t70 -81.8 -45.47 15.54 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.864 172.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.867 HG22 ' HG3' ' A' ' 983' ' ' GLU . 24.5 t -53.89 -62.16 0.76 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.806 177.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.77 HG12 ' O ' ' A' 1035 ' ' LEU . 8.2 pt -84.0 -27.46 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -173.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.612 ' O ' ' HG3' ' A' 1043 ' ' ARG . 26.5 t70 -61.06 -30.8 70.54 Favored 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 118.145 -1.422 . . . . 0.0 108.893 163.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.547 ' O ' ' HD3' ' A' 1045 ' ' LYS . 73.6 mt-30 -79.76 -24.04 41.81 Favored 'General case' 0 C--O 1.203 -1.394 0 C-N-CA 119.072 -1.051 . . . . 0.0 110.677 169.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -58.22 -52.63 64.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.331 0.586 . . . . 0.0 109.822 173.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 1.134 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 6.5 ppt_? -57.3 -32.09 66.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.677 176.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' 1043 ' ' ARG . 51.7 tp -78.95 -29.68 44.16 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.177 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.716 ' HG2' ' HA ' ' A' ' 980' ' ' THR . 12.0 mptt -61.52 -43.23 99.23 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.684 0.793 . . . . 0.0 110.167 175.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.1 ttt -64.33 -35.03 79.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.567 176.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.552 ' O ' ' HG2' ' A' 1051 ' ' ARG . 45.6 mm -70.72 -43.54 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.914 174.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.5 m -51.74 -33.01 32.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.014 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.418 ' HA ' ' OE1' ' A' 1049 ' ' GLN . 6.8 tp60 -83.46 -29.65 27.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.682 0.277 . . . . 0.0 111.042 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 3.1 p -88.15 -10.83 48.69 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' 1047 ' ' ILE . 13.2 ptm180 -133.29 104.74 12.3 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 121.188 0.518 . . . . 0.0 110.191 173.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -67.05 -16.66 49.9 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 123.107 2.538 . . . . 0.0 112.686 -178.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 10.1 p80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.561 -0.733 . . . . 0.0 109.974 178.887 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 25.0 tpt180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 63.9 m 68.92 -1.71 1.97 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.563 0.697 . . . . 0.0 110.626 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.885 ' OD1' ' HA ' ' A' 1040 ' ' ASP . 0.4 OUTLIER 64.77 74.66 0.39 Allowed 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 114.364 -1.289 . . . . 0.0 113.952 174.436 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.558 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 37.1 t70 -48.88 -173.77 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 111.907 -2.406 . . . . 0.0 113.277 -173.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.662 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.0 tmtp? -41.08 -14.52 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.617 1.167 . . . . 0.0 112.88 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.768 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.5 m -63.6 -51.58 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 C-N-CA 122.959 0.503 . . . . 0.0 112.042 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.772 ' HB2' ' OD1' ' A' ' 922' ' ' ASN . 49.0 t80 -75.49 -34.12 60.85 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 122.257 1.027 . . . . 0.0 108.384 -178.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.625 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 40.5 mt-10 -64.94 -58.7 5.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 113.475 -1.693 . . . . 0.0 112.59 -176.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.662 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 3.6 t-20 -73.36 -31.02 63.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -171.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.735 ' CG2' HD11 ' A' 1039 ' ' ILE . 22.7 t -68.28 -35.86 72.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 119.148 -1.021 . . . . 0.0 110.793 176.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.48 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 90.5 m -56.86 -25.31 56.29 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.553 0.692 . . . . 0.0 109.969 163.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . 0.477 ' HA2' ' HG2' ' A' ' 934' ' ' LYS . . . -71.84 -26.88 71.76 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.526 176.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.729 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.4 tt -61.93 -41.35 97.84 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 172.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.65 ' O ' HG12 ' A' ' 937' ' ' ILE . 45.0 t -61.06 -45.2 99.03 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.409 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.979 175.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.499 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.3 mmpt? -54.67 -44.49 73.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.551 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.708 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.01 -28.65 60.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.7 -178.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.8 p -77.62 -18.38 14.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 C-N-CA 119.869 -0.732 . . . . 0.0 109.629 174.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 933' ' ' VAL . 34.8 mm -67.95 -26.08 33.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 169.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 35.5 mm-40 -64.9 -42.47 94.74 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.322 173.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.724 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 2.6 ptt? -55.64 -42.14 74.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.331 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.481 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 9.7 p -75.07 -35.22 61.85 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.444 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 12.1 p -77.6 -48.95 15.63 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.264 0.554 . . . . 0.0 111.067 -176.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.465 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -68.64 -22.19 64.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.386 -176.169 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.69 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 10.4 tp -79.89 -22.75 11.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.669 175.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.709 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 33.7 mm-40 -49.3 -54.97 24.44 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.826 -0.17 . . . . 0.0 110.96 175.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 76.2 Cg_endo -95.24 30.22 0.21 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.614 1.543 . . . . 0.0 113.2 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.934 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -133.11 153.26 80.76 Favored Pre-proline 0 CA--C 1.532 0.27 0 N-CA-C 113.666 0.988 . . . . 0.0 113.666 -173.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.631 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.9 Cg_endo -92.88 -175.23 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 124.025 3.15 . . . . 0.0 111.968 174.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.911 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 9.7 Cg_endo -53.17 -30.53 51.01 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.875 2.384 . . . . 0.0 112.836 176.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.404 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 32.2 mm-40 -57.66 -29.52 64.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.061 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.934 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 48.9 mm-40 -102.02 0.86 35.76 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.088 0.243 . . . . 0.0 111.198 175.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.911 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 1.7 m-85 -59.26 -44.03 92.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.023 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.4 OUTLIER -74.78 -48.09 4.93 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.392 176.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.023 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.7 Cg_exo -55.77 -23.63 42.56 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 121.696 1.598 . . . . 0.0 114.596 172.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.751 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 22.2 ptt? -73.32 -36.44 66.23 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.114 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 1.035 ' HB ' ' HG3' ' A' 1002 ' ' MET . 0.5 OUTLIER -66.63 -27.22 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.085 172.763 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 83.1 tttt -55.15 -42.1 72.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 175.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -53.86 -47.44 71.0 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.462 173.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.623 HG12 ' HA ' ' A' ' 936' ' ' VAL . 0.9 OUTLIER -68.47 -23.59 28.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.223 176.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.568 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -66.26 -42.69 94.01 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 174.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 963' ' ' ARG . 84.5 mt -70.27 -10.27 58.43 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.27 0.557 . . . . 0.0 110.362 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -78.83 -56.24 4.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.925 -179.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.717 HD12 ' HB3' ' A' ' 991' ' ' LEU . 2.6 tt -66.67 -29.06 68.99 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.285 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.504 ' HD2' HD23 ' A' ' 960' ' ' LEU . 54.9 mtt-85 -59.56 -61.42 2.63 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.069 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 5.3 m -56.1 -30.66 62.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.059 0.457 . . . . 0.0 110.95 174.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.727 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -67.12 -41.43 86.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.912 -178.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -52.91 -35.48 58.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.377 174.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -60.91 -49.4 77.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.142 0.496 . . . . 0.0 110.068 175.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.2 m -58.24 -42.86 87.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.775 171.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.716 HG13 HD11 ' A' ' 984' ' ' ILE . 53.3 t -54.42 -30.96 22.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.422 0.153 . . . . 0.0 111.168 174.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.632 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 19.3 t70 -71.62 -26.09 62.43 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 177.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.539 ' O ' HG23 ' A' ' 975' ' ' VAL . 39.1 mm-40 -69.09 -44.89 71.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.383 1.087 . . . . 0.0 108.889 169.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.604 ' OG ' HG21 ' A' ' 980' ' ' THR . 33.4 t -66.36 -24.56 66.52 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.857 178.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.704 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 0.5 OUTLIER -60.71 -52.98 68.73 Favored Pre-proline 0 C--O 1.214 -0.783 0 CA-C-O 118.295 -0.859 . . . . 0.0 111.639 -177.264 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.632 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 10.5 Cg_endo -58.71 -26.82 81.29 Favored 'Trans proline' 0 C--N 1.359 1.116 0 CA-C-N 121.676 1.634 . . . . 0.0 111.373 170.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.567 HG13 ' HB2' ' A' 1046 ' ' MET . 2.1 t -75.82 -15.9 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 119.43 -0.908 . . . . 0.0 110.527 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 1.039 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 1.6 tt -64.53 -52.68 50.73 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 118.783 -0.627 . . . . 0.0 111.695 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.669 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 31.5 Cg_exo -62.71 -30.26 78.25 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 121.409 1.406 . . . . 0.0 111.084 175.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.27 -57.33 10.8 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.173 175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.824 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 17.1 m -165.49 -36.36 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.242 0.544 . . . . 0.0 112.194 -174.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.792 HG22 ' HB ' ' A' ' 984' ' ' ILE . 70.7 m -56.18 -22.71 30.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -173.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 1.039 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 24.7 p-80 -51.05 -30.02 14.45 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.054 0.843 . . . . 0.0 112.808 -172.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 40.3 mtm105 -62.28 -55.39 28.7 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.927 -0.709 . . . . 0.0 111.532 173.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.758 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.5 OUTLIER -76.47 -47.29 23.44 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.471 -0.491 . . . . 0.0 112.198 -174.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.792 ' HB ' HG22 ' A' ' 980' ' ' THR . 13.0 tt -55.27 -37.97 45.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.429 -172.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 2.9 pp20? -73.28 -31.7 64.22 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.181 -178.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.741 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 18.0 ptp -62.54 -56.76 14.97 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.218 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.707 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.11 -33.16 44.62 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.802 ' HA ' HD12 ' A' ' 991' ' ' LEU . 57.7 tt0 -60.43 -44.69 95.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.306 -178.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.565 ' HG3' ' O ' ' A' ' 985' ' ' GLU . 28.0 mtmm -64.73 -34.04 77.39 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.555 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 3.0 tp -64.12 -46.31 84.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.495 177.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.042 HD11 ' HG ' ' A' 1035 ' ' LEU . 13.2 mt -54.51 -60.14 3.76 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-O 121.075 0.464 . . . . 0.0 110.568 175.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -50.99 -43.03 60.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.241 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.558 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 42.0 t -62.35 -56.94 13.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.957 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.46 ' O ' HD23 ' A' ' 998' ' ' LEU . 1.8 m-20 -83.15 -42.89 16.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -168.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.925 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.8 OUTLIER -53.1 -55.1 26.55 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.812 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.701 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -54.75 -43.82 73.04 Favored 'General case' 0 N--CA 1.46 0.067 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 174.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.735 ' O ' ' HG2' ' A' 1001 ' ' LYS . 36.5 mt-10 -54.24 -43.29 70.77 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.679 -0.808 . . . . 0.0 109.241 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.719 ' O ' ' HG2' ' A' 1002 ' ' MET . 4.1 mm? -63.64 -36.47 83.92 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.049 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.88 ' HA ' HG11 ' A' ' 955' ' ' VAL . 11.1 pt -71.04 -7.87 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 C-N-CA 119.99 -0.684 . . . . 0.0 109.972 -177.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.7 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 13.7 m-80 -113.13 -15.3 12.8 Favored 'General case' 0 C--O 1.207 -1.145 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.735 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 21.8 mmmt -73.75 -32.73 63.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.035 ' HG3' ' HB ' ' A' ' 955' ' ' VAL . 12.3 mmt -78.55 -42.02 30.46 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.7 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 16.1 tppt? -55.4 -45.18 76.66 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.206 169.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' 1004 ' ' LEU . 14.6 mt -61.51 -48.21 82.1 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 123.687 0.617 . . . . 0.0 112.286 175.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.78 -44.1 86.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.169 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.63 ' HG3' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -76.48 -16.56 59.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.841 178.12 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.684 ' HB2' ' O ' ' A' 1003 ' ' LYS . 7.6 tp-100 -81.42 -36.72 29.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.315 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.586 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 1.2 t80 -73.05 -66.44 0.68 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.332 178.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . . . . . . . . . 9.4 p 38.76 37.18 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 124.663 1.227 . . . . 0.0 112.129 178.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 24.0 ttt -90.4 106.34 18.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.503 -174.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 46.7 p 44.47 -95.68 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.458 0 O-C-N 124.339 1.025 . . . . 0.0 112.758 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 50.5 m -135.68 9.86 3.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.413 0.625 . . . . 0.0 109.967 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.12 -5.53 59.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.02 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.8 -27.15 62.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.618 177.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.96 -31.6 65.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.559 ' O ' ' HG2' ' A' 1020 ' ' GLN . 34.8 tt0 -54.46 -54.31 42.63 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.849 170.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.586 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.7 m-85 -60.21 -35.88 76.43 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.007 175.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -62.12 -36.34 81.48 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.597 0.237 . . . . 0.0 110.974 171.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' 1016 ' ' GLU . 14.5 tppt? -63.28 -54.9 30.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.041 0.448 . . . . 0.0 110.063 175.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' 1016 ' ' GLU . 6.8 mm-40 -51.3 -37.77 49.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.212 173.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . . . . . . . . . 1.8 tmt? -65.69 -41.8 91.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.122 177.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 69.8 mt -60.5 -44.25 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.792 0.33 . . . . 0.0 111.408 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.8 m -66.04 -46.7 76.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.232 0.539 . . . . 0.0 110.229 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.639 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -62.28 -43.41 98.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.191 178.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.486 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -60.39 -31.57 70.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.775 0.321 . . . . 0.0 111.009 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' 1030 ' ' VAL . 12.2 t-80 -75.76 -35.69 60.08 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.575 -0.45 . . . . 0.0 109.847 176.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.61 -45.39 94.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 175.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.925 HD12 ' HA ' ' A' ' 995' ' ' LEU . 1.8 tt -56.29 -55.82 28.58 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 121.605 0.717 . . . . 0.0 111.004 171.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -52.98 -28.79 25.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.005 176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' 1026 ' ' HIS . 77.4 t -74.11 -41.64 51.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 119.619 -0.229 . . . . 0.0 111.519 173.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.747 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -61.53 -46.93 87.85 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.09 177.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.547 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -53.77 -40.46 66.25 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-O 120.76 0.314 . . . . 0.0 111.79 169.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.534 ' O ' ' HG ' ' A' 1036 ' ' LEU . 88.6 tttt -77.37 -35.04 54.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.424 0.631 . . . . 0.0 110.246 -172.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.453 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -75.41 -45.57 38.1 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.988 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 1.042 ' HG ' HD11 ' A' ' 991' ' ' LEU . 3.4 tm? -67.99 -33.68 75.09 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.96 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' 1040 ' ' ASP . 4.2 pp -64.74 -29.34 70.32 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 175.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.48 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 20.8 t70 -84.98 -37.67 20.17 Favored 'General case' 0 C--N 1.331 -0.227 0 O-C-N 123.887 0.742 . . . . 0.0 109.511 178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.758 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 5.7 t -52.88 -52.97 23.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.654 172.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.808 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 24.4 pt -90.48 -22.77 6.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.885 ' HA ' ' OD1' ' A' ' 922' ' ' ASN . 6.2 t70 -44.81 -49.26 10.86 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 157.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 28.3 mt-30 -78.44 -27.33 46.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 113.859 -1.519 . . . . 0.0 111.481 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.808 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.68 -56.12 22.53 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 118.333 0.515 . . . . 0.0 111.46 175.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.608 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.1 OUTLIER -57.82 -32.3 67.45 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.336 176.49 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 89.6 mt -78.87 -13.1 59.99 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.762 174.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.824 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 29.7 mmtp -73.24 -35.47 66.26 Favored 'General case' 0 CA--C 1.502 -0.871 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.567 ' HB2' HG13 ' A' ' 975' ' ' VAL . 59.8 ttm -66.42 -40.65 89.66 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.669 173.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.03 -35.0 62.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.794 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 22.3 t -70.12 -33.87 72.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.02 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -78.46 -31.49 47.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.743 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 49.4 m -81.71 -34.09 30.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.356 175.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 66.2 mtp180 73.02 133.39 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.347 0 C-N-CA 123.823 0.849 . . . . 0.0 111.392 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.38 147.23 86.39 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.976 2.45 . . . . 0.0 112.332 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 13.7 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.504 -0.76 . . . . 0.0 110.226 -178.571 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.678 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 2.1 tpm_? . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 35.2 t 73.53 -0.24 3.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.035 0.534 . . . . 0.0 111.668 176.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.4 OUTLIER 52.54 68.75 0.78 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-O 121.598 0.714 . . . . 0.0 111.247 175.12 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 925' ' ' VAL . 45.3 t0 -45.1 -171.78 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 112.105 -2.316 . . . . 0.0 112.687 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.688 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 2.3 tmtp? -34.9 -21.44 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.392 1.077 . . . . 0.0 113.007 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.817 HG21 ' HB2' ' A' 1043 ' ' ARG . 0.5 OUTLIER -56.36 -56.17 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 172.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -78.02 -30.54 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.156 0.979 . . . . 0.0 108.527 -177.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 86.4 mt-10 -60.31 -50.92 71.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.978 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.493 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 32.3 t-20 -66.1 -44.46 84.3 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.346 -174.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.57 ' HB ' ' HB3' ' A' 1036 ' ' LEU . 4.1 t -62.44 -30.97 50.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.057 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.539 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 56.4 m -64.05 -34.77 78.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.881 0.848 . . . . 0.0 109.146 171.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.95 -28.0 62.94 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.85 172.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.998 HD12 HD13 ' A' ' 965' ' ' LEU . 3.7 tt -66.92 -49.17 66.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 117.455 0.627 . . . . 0.0 109.745 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 937' ' ' ILE . 3.4 m -63.01 -32.24 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.895 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.539 ' HD2' ' O ' ' A' ' 930' ' ' THR . 1.3 mpmm? -65.07 -28.41 69.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.854 0.359 . . . . 0.0 110.994 174.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.664 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -82.14 -26.03 33.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.9 0.381 . . . . 0.0 111.265 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.574 ' HA ' HG12 ' A' ' 958' ' ' VAL . 9.7 p -80.81 -10.43 12.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.124 172.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 933' ' ' VAL . 41.7 mm -71.86 -36.87 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 166.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 41.2 mt-10 -57.74 -45.05 86.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.668 170.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.58 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.8 tmt? -59.2 -45.2 91.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.682 176.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.732 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 16.9 t -64.27 -37.98 89.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.308 -177.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.573 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 2.5 p -77.11 -38.87 51.3 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 -176.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.646 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.7 mmtp -52.87 -49.96 64.79 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.683 175.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.738 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.2 tt -71.1 -23.74 23.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -175.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.811 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 84.7 mm-40 -59.38 -64.75 2.6 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -175.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.811 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -101.29 5.55 0.59 Allowed 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 121.667 1.578 . . . . 0.0 113.832 -174.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.511 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -110.62 157.22 38.98 Favored Pre-proline 0 C--N 1.323 -0.572 0 C-N-CA 120.627 -0.429 . . . . 0.0 112.098 -173.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.99 176.37 9.46 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.417 2.744 . . . . 0.0 112.237 177.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.719 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 77.7 Cg_exo -53.29 -24.93 28.72 Favored 'Trans proline' 0 C--O 1.245 0.863 0 C-N-CA 123.318 2.679 . . . . 0.0 113.289 176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -54.55 -31.27 56.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.097 174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.553 ' OE1' ' HE2' ' A' ' 942' ' ' LYS . 10.7 mm-40 -100.96 1.18 39.48 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.323 178.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.719 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 13.7 m-30 -64.27 -39.01 93.07 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 172.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.037 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -73.18 -51.22 6.08 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.591 174.856 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.007 ' HD3' HG13 ' A' ' 952' ' ' VAL . 84.3 Cg_exo -51.62 -36.86 62.24 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.157 1.905 . . . . 0.0 114.742 172.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.738 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 26.4 ptt? -62.71 -46.99 85.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.394 0.616 . . . . 0.0 110.054 -177.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.586 ' O ' HG22 ' A' ' 958' ' ' VAL . 89.4 t -68.21 -26.55 34.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 173.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 87.3 tttt -58.75 -38.11 77.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 6.1 mm-40 -55.37 -46.88 76.45 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.855 174.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.5 m -74.24 -22.35 17.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 O-C-N 122.202 -0.311 . . . . 0.0 111.829 177.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.566 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.48 -44.0 66.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.135 -1.031 . . . . 0.0 111.479 177.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.3 mm? -64.42 -27.78 69.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.588 0.232 . . . . 0.0 110.768 171.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.686 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.62 -56.91 16.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.218 177.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.573 HD12 ' HB3' ' A' ' 991' ' ' LEU . 5.1 tt -63.03 -36.57 84.01 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 121.191 -0.204 . . . . 0.0 111.057 177.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.436 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 46.1 ttt180 -59.85 -53.47 57.51 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 176.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.8 m -55.92 -40.9 73.76 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.848 0.832 . . . . 0.0 109.914 174.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.998 HD13 HD12 ' A' ' 932' ' ' LEU . 2.2 tt -60.78 -29.51 69.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.851 176.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.436 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.1 tp -68.03 -29.56 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.549 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.33 -38.33 90.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.352 0.596 . . . . 0.0 109.668 173.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.754 HG23 ' HA ' ' A' ' 925' ' ' VAL . 1.3 m -71.2 -33.69 70.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.101 174.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 965' ' ' LEU . 78.6 t -55.12 -30.99 24.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.537 171.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.49 ' HA ' ' HB2' ' A' ' 973' ' ' LEU . 24.6 t70 -77.87 -26.23 49.12 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 177.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.549 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.5 mm-40 -65.91 -54.25 28.93 Favored 'General case' 0 C--O 1.25 1.079 0 CA-C-O 123.344 1.545 . . . . 0.0 108.514 170.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.439 ' O ' HD13 ' A' ' 976' ' ' LEU . 46.6 t -62.84 -26.94 69.0 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.657 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.761 ' HA ' HD13 ' A' ' 976' ' ' LEU . 4.9 tt -57.33 -52.99 70.09 Favored Pre-proline 0 N--CA 1.472 0.674 0 CA-C-O 118.597 -0.716 . . . . 0.0 112.421 -174.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 51.7 Cg_exo -55.19 -30.75 72.82 Favored 'Trans proline' 0 C--N 1.355 0.907 0 CA-C-N 121.178 1.456 . . . . 0.0 110.541 170.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 2.6 t -77.05 -13.71 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.618 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.878 ' HG ' HG21 ' A' ' 984' ' ' ILE . 5.8 mp -61.72 -64.45 3.07 Favored Pre-proline 0 N--CA 1.472 0.66 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.8 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.741 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 17.3 Cg_endo -58.21 -28.19 83.24 Favored 'Trans proline' 0 C--N 1.364 1.361 0 C-N-CA 121.505 1.47 . . . . 0.0 111.291 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.629 ' O ' ' HG3' ' A' 1049 ' ' GLN . . . -59.52 -52.2 66.61 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.513 173.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 1.052 ' HB3' ' HB3' ' A' 1045 ' ' LYS . 3.5 t -171.58 -33.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.034 0.445 . . . . 0.0 112.044 -177.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.985 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.0 m -63.81 -22.19 66.79 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -172.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.448 ' HA ' HG22 ' A' ' 984' ' ' ILE . 15.8 t-80 -53.21 -21.56 5.38 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -175.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 46.8 mtm105 -76.1 -54.78 6.33 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.256 -0.577 . . . . 0.0 111.162 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.762 ' CG ' HG22 ' A' 1038 ' ' VAL . 3.4 tp10 -74.49 -43.14 57.35 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.426 -0.509 . . . . 0.0 111.374 -178.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.985 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.2 OUTLIER -59.45 -37.71 71.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 -174.527 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.27 -43.88 83.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.543 174.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.696 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.8 ptm -63.02 -47.91 81.04 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.143 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.791 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -79.44 -43.54 23.09 Favored 'General case' 0 C--O 1.217 -0.649 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -175.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.839 ' HA ' HD12 ' A' ' 991' ' ' LEU . 61.5 tt0 -60.27 -45.98 91.42 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.974 -0.291 . . . . 0.0 111.544 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -66.54 -31.02 71.47 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.413 ' HG ' ' HB2' ' A' 1031 ' ' ASP . 1.8 tp -65.93 -40.39 91.36 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.359 175.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.043 HD11 HD22 ' A' 1035 ' ' LEU . 18.5 mt -58.07 -56.28 24.13 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.519 0.676 . . . . 0.0 110.557 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.99 -31.8 63.36 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.75 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.5 m -76.07 -36.34 59.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.838 -177.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -102.55 -31.47 10.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.706 -0.798 . . . . 0.0 113.06 -174.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.876 ' HA ' HD12 ' A' 1028 ' ' LEU . 1.5 tm? -59.41 -41.25 89.06 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 168.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -63.61 -44.63 93.37 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.152 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.52 ' O ' ' HD3' ' A' 1001 ' ' LYS . 19.2 mm-40 -53.14 -43.33 66.9 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.681 173.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.861 HD12 HD13 ' A' 1028 ' ' LEU . 2.4 mt -67.26 -28.97 68.47 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.853 -0.739 . . . . 0.0 109.74 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 995' ' ' LEU . 44.0 mm -66.23 -43.21 91.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.837 177.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.589 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.2 m-20 -79.31 -15.2 58.31 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.853 177.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.52 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -87.17 -36.83 17.81 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.204 0.315 . . . . 0.0 111.371 178.464 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.037 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 24.7 ptt? -65.71 -39.48 91.25 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 169.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 58.9 tttm -62.56 -53.31 56.54 Favored 'General case' 0 C--O 1.204 -1.322 0 CA-C-N 114.021 -1.445 . . . . 0.0 108.511 174.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' 1000 ' ' ASN . 21.5 tp -49.29 -56.38 9.64 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.352 1.061 . . . . 0.0 113.489 177.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -58.84 -45.85 89.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.479 0.657 . . . . 0.0 110.18 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' 1003 ' ' LYS . 1.4 pp0? -76.54 -11.06 59.81 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.086 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.0 OUTLIER -81.27 -40.31 23.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.267 -176.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.545 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 11.7 m-85 -115.68 22.37 13.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.807 177.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.645 HG23 ' HG2' ' A' ' 948' ' ' PRO . 1.5 p -28.93 116.93 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 11.3 tpt 81.34 164.22 0.15 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.779 165.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.3 m 76.41 74.85 0.08 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.305 174.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 65.1 m 64.25 -70.33 0.08 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 171.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' 1013 ' ' LEU . 3.6 mm? -61.67 -15.59 41.37 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -169.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.501 ' HA ' ' HD2' ' A' 1017 ' ' TYR . 0.7 OUTLIER -52.93 -44.8 67.29 Favored 'General case' 0 C--O 1.219 -0.525 0 O-C-N 123.05 0.219 . . . . 0.0 110.495 -176.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -55.07 -34.83 63.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.555 ' HG2' ' CE1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -48.05 -50.31 28.43 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.825 0.821 . . . . 0.0 110.882 168.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.588 ' HB3' ' HG ' ' A' 1004 ' ' LEU . 14.5 m-85 -78.98 -20.06 50.08 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.668 -175.301 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.507 ' O ' ' HG ' ' A' 1022 ' ' LEU . 19.0 ttmm -72.34 -33.13 67.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.211 169.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.416 ' HB3' ' HE3' ' A' 1019 ' ' LYS . 20.6 mmmt -74.42 -56.67 4.59 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.566 -179.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.511 ' HG3' ' O ' ' A' 1016 ' ' GLU . 44.2 mt-30 -50.8 -31.7 17.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.466 ' HA ' ' CG ' ' A' 1001 ' ' LYS . 14.9 tmm? -67.85 -45.95 73.14 Favored 'General case' 0 C--O 1.23 0.06 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.266 175.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' 1018 ' ' LYS . 95.8 mt -60.54 -40.14 90.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.874 177.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 24.8 m -62.59 -34.17 76.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 0.0 110.582 177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.42 -42.04 31.23 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.069 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.504 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -61.83 -38.43 88.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.05 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.6 ' O ' HG23 ' A' 1030 ' ' VAL . 19.0 t-80 -69.08 -47.92 64.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.375 178.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.14 -34.94 75.8 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.441 0.463 . . . . 0.0 110.427 178.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.7 OUTLIER -63.12 -50.05 72.0 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.685 0.755 . . . . 0.0 110.385 174.688 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.56 -37.53 68.13 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.053 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 1026 ' ' HIS . 57.2 t -67.57 -30.57 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 175.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.7 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.0 p30 -75.14 -39.35 60.55 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.711 -0.795 . . . . 0.0 109.029 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.423 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -62.19 -53.16 59.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.19 172.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.521 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 27.0 mtpp -61.89 -39.73 92.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.814 -177.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.625 ' O ' HG23 ' A' 1038 ' ' VAL . 7.4 t30 -68.55 -38.01 80.43 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.111 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 1.043 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.36 -26.08 46.56 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.09 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.57 ' HB3' ' HB ' ' A' ' 929' ' ' VAL . 4.4 pp -74.11 -21.57 59.84 Favored 'General case' 0 C--O 1.211 -0.944 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.433 ' O ' ' HG3' ' A' 1041 ' ' GLN . 3.9 m-20 -82.23 -46.53 13.59 Favored 'General case' 0 C--N 1.322 -0.597 0 O-C-N 123.967 0.792 . . . . 0.0 109.163 170.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.791 HG21 ' HB2' ' A' ' 987' ' ' ALA . 29.0 t -50.6 -57.07 2.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.482 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.812 ' CG2' ' HB ' ' A' ' 925' ' ' VAL . 17.2 mt -73.36 -35.97 47.59 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.471 -1.24 . . . . 0.0 111.95 -177.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' 1036 ' ' LEU . 5.0 t70 -50.98 -45.46 60.96 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 166.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.64 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.9 mt-30 -72.57 -29.34 63.45 Favored 'General case' 0 C--O 1.209 -1.051 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.09 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' 1045 ' ' LYS . . . -54.03 -58.03 8.82 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 121.043 0.449 . . . . 0.0 111.777 177.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.817 ' HB2' HG21 ' A' ' 925' ' ' VAL . 0.6 OUTLIER -59.51 -28.83 67.41 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.356 177.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 40.1 tp -77.42 -25.82 51.1 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.451 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 1.052 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 3.6 mmpm? -63.33 -33.59 75.86 Favored 'General case' 0 CA--C 1.502 -0.871 0 CA-C-O 121.855 0.836 . . . . 0.0 109.091 175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 27.9 ttt -64.72 -43.6 92.91 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.301 -1.318 . . . . 0.0 109.275 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.496 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 50.1 mm -60.85 -43.11 94.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.0 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' 1045 ' ' LYS . 66.3 m -53.97 -29.61 43.52 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.219 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' ' 978' ' ' ALA . 26.5 mm-40 -108.95 -28.46 9.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -176.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 35.3 t -72.98 -21.82 60.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.842 -0.163 . . . . 0.0 111.116 -177.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' A' 1051 ' ' ARG . 12.2 tpt180 -127.66 108.26 20.67 Favored Pre-proline 0 C--N 1.328 -0.356 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.386 -177.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.39 -39.69 5.06 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.808 2.339 . . . . 0.0 111.195 173.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 26.5 t60 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.532 -0.746 . . . . 0.0 109.67 176.89 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 1.018 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 38.2 m 74.27 22.75 2.17 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.888 0.742 . . . . 0.0 111.034 -174.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 1.018 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 44.02 55.65 5.2 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.999 176.091 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 925' ' ' VAL . 14.0 m-20 -46.52 -175.15 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.487 0 O-C-N 125.121 1.513 . . . . 0.0 112.582 -178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.556 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 5.4 tmtp? -33.06 -24.76 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.667 1.187 . . . . 0.0 113.243 179.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.799 HG21 ' HB2' ' A' 1043 ' ' ARG . 4.9 m -61.85 -53.38 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-O 119.194 -0.431 . . . . 0.0 112.081 175.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.601 ' HB2' ' HB2' ' A' 1040 ' ' ASP . 71.2 t80 -78.4 -27.29 46.69 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.546 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 44.5 mt-10 -64.97 -61.12 2.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.62 -1.173 . . . . 0.0 111.901 -178.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.556 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -70.02 -34.53 73.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.11 -172.726 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.96 ' HB ' HD11 ' A' 1039 ' ' ILE . 12.7 p -62.36 -34.76 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.816 175.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.543 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 57.2 m -68.1 -35.36 78.03 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.94 -28.39 63.46 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.416 172.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.66 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.5 tt -63.39 -42.93 98.83 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 175.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 937' ' ' ILE . 42.4 t -63.97 -38.12 81.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.263 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 934' ' ' LYS . 10.5 mmpt? -65.11 -33.95 77.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.992 0.425 . . . . 0.0 110.469 177.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -76.2 -26.13 55.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.338 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.722 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -83.38 -14.14 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 119.796 -0.762 . . . . 0.0 109.673 173.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.591 HG12 ' O ' ' A' ' 933' ' ' VAL . 39.7 mm -70.08 -35.79 65.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 166.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.609 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 46.5 mt-10 -54.35 -43.65 71.48 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.365 170.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.641 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.2 ttp -58.46 -43.59 88.93 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.596 0.56 . . . . 0.0 110.356 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.576 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 16.7 m -65.6 -37.18 85.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.093 -178.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.6 m -77.3 -43.06 34.52 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -177.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.695 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 5.4 mmtm -49.94 -57.65 7.05 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.601 -1.636 . . . . 0.0 111.259 176.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 12.9 tt -62.5 -29.27 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -174.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.786 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.5 mt-30 -50.29 -60.69 4.8 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.786 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 18.1 Cg_endo -93.37 0.94 3.44 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.499 1.466 . . . . 0.0 113.879 177.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.884 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -90.16 148.43 39.3 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.57 175.34 6.2 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.902 3.068 . . . . 0.0 110.064 165.153 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.677 ' HG3' HG21 ' A' 1009 ' ' VAL . 9.9 Cg_endo -51.87 -31.01 40.94 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.742 2.295 . . . . 0.0 112.511 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -57.54 -33.27 67.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.081 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.884 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.3 mp0 -98.73 -0.27 43.11 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 122.953 0.158 . . . . 0.0 111.297 175.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.726 ' O ' ' HG2' ' A' ' 954' ' ' MET . 10.1 m-30 -65.55 -37.84 87.88 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 175.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.094 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -78.42 -45.16 2.08 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.163 173.447 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.094 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.4 Cg_exo -53.81 -28.43 47.94 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 121.829 1.686 . . . . 0.0 113.999 170.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 16.6 ptt? -72.87 -37.89 67.21 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 119.709 -0.796 . . . . 0.0 109.465 178.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.785 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.3 OUTLIER -64.82 -26.49 40.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.702 171.494 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 55.7 tttt -57.0 -40.77 77.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -55.67 -46.17 77.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.49 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 936' ' ' VAL . 1.6 m -72.77 -22.7 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-O 120.798 0.332 . . . . 0.0 111.179 176.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.57 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -69.28 -44.27 66.56 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.175 177.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 960' ' ' LEU . 4.2 mm? -63.78 -24.07 67.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.566 -0.317 . . . . 0.0 110.948 172.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -61.1 -57.82 10.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.324 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.69 ' HB2' HD13 ' A' ' 995' ' ' LEU . 22.8 tp -68.71 -34.42 75.61 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.637 -0.425 . . . . 0.0 112.016 178.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 959' ' ' GLY . 75.1 mtp180 -59.57 -55.23 37.1 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 121.772 -0.58 . . . . 0.0 112.437 175.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.44 HG22 ' OD1' ' A' ' 928' ' ' ASN . 14.7 m -57.88 -34.7 70.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.584 0.707 . . . . 0.0 110.242 174.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.674 HD11 HD21 ' A' 1035 ' ' LEU . 3.0 tm? -63.81 -29.0 70.24 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.235 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.476 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 0.2 OUTLIER -66.94 -28.16 68.06 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.687 -178.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.06 89.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.381 0.61 . . . . 0.0 109.836 172.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.747 HG23 ' HA ' ' A' ' 925' ' ' VAL . 3.3 m -58.55 -39.68 80.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.61 172.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.555 HG13 HD11 ' A' ' 984' ' ' ILE . 72.7 t -54.07 -30.55 20.22 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.307 174.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.514 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.2 t70 -74.65 -24.06 58.77 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.59 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.6 mm-40 -71.91 -51.22 23.28 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.83 1.3 . . . . 0.0 109.135 169.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.422 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 30.9 t -65.45 -24.56 67.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 113.803 -1.544 . . . . 0.0 111.056 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.652 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 28.4 tp -63.76 -50.17 72.61 Favored Pre-proline 0 C--O 1.219 -0.508 0 CA-C-O 118.468 -0.777 . . . . 0.0 112.454 -175.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.613 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.8 Cg_exo -59.23 -26.49 81.98 Favored 'Trans proline' 0 C--N 1.356 0.964 0 CA-C-N 121.096 1.427 . . . . 0.0 110.827 169.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' 1042 ' ' ALA . 38.7 t -75.09 -16.71 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.726 174.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.813 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 0.3 OUTLIER -64.57 -54.85 33.78 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.81 176.231 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 29.2 Cg_exo -62.2 -25.61 77.09 Favored 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 120.962 1.379 . . . . 0.0 110.406 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -68.11 -61.6 1.78 Allowed 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.656 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.896 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 9.6 m -163.45 -50.22 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -172.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.529 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 4.9 t -53.28 -15.99 1.15 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -172.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.813 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 8.9 p-80 -47.94 -20.78 0.35 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 982' ' ' ARG . 9.1 tpt180 -76.86 -52.24 9.83 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.465 -0.894 . . . . 0.0 110.488 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.989 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.0 OUTLIER -76.61 -39.07 53.61 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.757 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' ' 981' ' ' HIS . 10.6 tt -63.06 -25.35 38.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.285 -0.566 . . . . 0.0 109.891 -176.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -73.5 -40.85 63.75 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.366 -0.534 . . . . 0.0 111.303 171.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.597 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 15.7 ptp -70.9 -51.2 27.63 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.842 -0.743 . . . . 0.0 112.052 -173.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.554 ' CB ' HG21 ' A' 1038 ' ' VAL . . . -78.76 -40.12 34.22 Favored 'General case' 0 C--O 1.217 -0.625 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -174.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' A' ' 991' ' ' LEU . 6.6 tt0 -61.56 -44.75 96.46 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.208 -177.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.43 -26.18 64.48 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.572 0.701 . . . . 0.0 109.136 178.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 8.6 tp -72.25 -37.35 69.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.823 178.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.036 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.4 mt -61.58 -53.42 56.5 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.982 176.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -57.03 -37.49 71.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.494 -174.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 4.5 p -71.65 -38.03 70.75 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -176.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.639 ' HA ' ' HB3' ' A' ' 997' ' ' GLU . 4.3 m-20 -106.77 -31.13 8.54 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 119.529 -0.868 . . . . 0.0 112.825 -172.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.017 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.7 OUTLIER -59.79 -45.46 92.22 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -65.75 -42.24 91.16 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.848 175.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.728 ' O ' ' HB2' ' A' 1001 ' ' LYS . 7.7 tp10 -53.03 -41.07 64.36 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.056 174.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.667 HD23 HD13 ' A' 1028 ' ' LEU . 40.9 tp -68.31 -38.99 82.14 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.243 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.785 ' HA ' HG11 ' A' ' 955' ' ' VAL . 77.7 mt -57.57 -51.21 72.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.298 0.57 . . . . 0.0 110.64 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.639 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -78.47 -11.72 59.97 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.531 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.728 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 0.8 OUTLIER -84.42 -32.95 23.83 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.311 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 998' ' ' LEU . 43.7 mmm -78.71 -39.49 36.33 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' 1007 ' ' GLN . 84.1 tttt -55.79 -51.01 68.91 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.536 -1.211 . . . . 0.0 108.488 169.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.7 tp -57.28 -46.2 83.33 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 174.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.422 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -60.57 -44.48 96.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.385 0.612 . . . . 0.0 110.35 178.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' 1003 ' ' LYS . 2.0 pp0? -76.68 -10.66 59.54 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.446 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' A' 1003 ' ' LYS . 5.6 tp-100 -87.95 -16.71 33.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.413 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 60.9 t80 -128.6 11.14 6.21 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.951 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.677 HG21 ' HG3' ' A' ' 948' ' ' PRO . 3.7 p -51.51 110.02 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.689 0.757 . . . . 0.0 111.699 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.532 ' HG3' ' HB2' ' A' 1013 ' ' LEU . 24.7 ptm -149.48 169.75 20.17 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.576 178.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 10.8 m -59.13 114.46 2.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 112.217 -175.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' 1015 ' ' GLN . 19.4 m 74.46 -34.06 0.26 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.801 0.84 . . . . 0.0 112.932 172.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.532 ' HB2' ' HG3' ' A' 1010 ' ' MET . 4.3 mm? -82.06 -7.84 59.63 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.206 -0.309 . . . . 0.0 111.557 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.569 ' HG3' HG23 ' A' 1009 ' ' VAL . 1.0 OUTLIER -64.87 -36.81 85.56 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.702 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 19.7 pt20 -61.69 -32.28 72.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.453 -177.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -50.44 -42.87 54.75 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 111.602 0.223 . . . . 0.0 111.602 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.609 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 4.5 m-30 -84.6 -19.62 32.74 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.225 0.536 . . . . 0.0 110.219 178.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.7 tttm -75.37 -32.11 60.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.49 177.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -76.44 -41.2 48.31 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -48.46 -40.14 25.3 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.554 166.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.623 ' HB3' ' O ' ' A' 1018 ' ' LYS . 1.3 tmt? -57.22 -46.71 82.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.252 173.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.57 -38.4 89.94 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.36 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 18.1 m -68.51 -37.08 79.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.894 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -77.91 -41.57 36.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.643 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.571 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -63.05 -31.79 73.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.258 0.552 . . . . 0.0 110.497 178.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' 1030 ' ' VAL . 6.0 t60 -71.64 -44.13 64.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.775 178.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -60.16 -44.86 94.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.698 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.017 HD12 ' HA ' ' A' ' 995' ' ' LEU . 5.5 tt -55.63 -53.53 55.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.909 -1.041 . . . . 0.0 111.178 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.77 -31.09 64.27 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.573 -179.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.748 ' HA ' ' HG2' ' A' 1033 ' ' LYS . 80.6 t -66.06 -43.51 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.867 174.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.561 ' HB3' HD23 ' A' ' 991' ' ' LEU . 8.4 m-20 -51.35 -46.4 62.68 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.05 0.452 . . . . 0.0 109.838 176.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.652 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -60.9 -53.25 59.54 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.117 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.748 ' HG2' ' HA ' ' A' 1030 ' ' VAL . 15.0 ptmm? -65.75 -32.14 73.52 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -174.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.677 ' O ' HG23 ' A' 1038 ' ' VAL . 4.8 t30 -73.43 -36.85 66.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.511 -0.475 . . . . 0.0 109.998 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.91 HD22 HD11 ' A' ' 991' ' ' LEU . 9.9 tp -79.81 -26.96 40.34 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.713 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.9 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.9 pp -64.79 -27.11 68.67 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.557 ' O ' ' HG2' ' A' 1041 ' ' GLN . 31.4 t70 -75.31 -45.91 36.7 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.219 -1.355 . . . . 0.0 108.921 170.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.989 HG13 ' HB3' ' A' ' 983' ' ' GLU . 55.7 t -53.31 -61.27 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.758 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.107 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.96 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.8 pt -81.33 -32.7 12.19 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -172.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.601 ' HB2' ' HB2' ' A' ' 926' ' ' TYR . 8.6 t0 -54.6 -44.53 73.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.201 166.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' A' 1045 ' ' LYS . 27.3 pt20 -78.47 -22.61 47.27 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.852 177.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.624 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.58 -55.35 30.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 118.478 0.581 . . . . 0.0 110.064 169.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.799 ' HB2' HG21 ' A' ' 925' ' ' VAL . 7.0 tpt180 -55.56 -33.86 64.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.131 175.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.507 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 66.1 tp -76.56 -26.3 54.98 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.439 175.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.896 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 69.0 mmtt -64.24 -34.63 78.55 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.0 ttp -71.41 -40.87 70.22 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.804 -1.543 . . . . 0.0 109.203 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.494 ' HB ' HD12 ' A' 1044 ' ' LEU . 48.6 mm -62.32 -35.02 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.809 172.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' 1045 ' ' LYS . 31.2 t -60.7 -40.19 91.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.316 -175.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -88.2 -17.14 31.49 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.561 -0.455 . . . . 0.0 111.621 -177.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 58.0 m -72.32 -33.63 67.49 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 171.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 54.32 82.3 0.25 Allowed Pre-proline 0 N--CA 1.461 0.1 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.509 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.77 12.16 2.46 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.222 2.614 . . . . 0.0 113.024 -177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 52.9 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.996 -178.092 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.84 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 6.7 tpt180 . . . . . 0 N--CA 1.449 -0.52 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.3 m -75.73 39.88 0.18 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.757 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.794 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.1 OUTLIER 43.32 69.93 0.35 Allowed 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 124.229 1.011 . . . . 0.0 111.801 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.456 ' O ' ' N ' ' A' ' 925' ' ' VAL . 2.1 t70 -47.02 -173.97 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 O-C-N 126.042 2.089 . . . . 0.0 113.058 -171.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.543 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 0.6 OUTLIER -46.54 -12.11 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.605 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.744 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 2.5 m -65.4 -54.65 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.751 171.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.458 ' CD1' ' HB2' ' A' 1040 ' ' ASP . 52.2 t80 -78.88 -29.13 44.21 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 122.144 0.973 . . . . 0.0 108.64 -176.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 38.5 mt-10 -65.41 -62.47 1.51 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.075 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.487 HD21 HG22 ' A' ' 964' ' ' THR . 57.3 t30 -71.56 -32.52 68.2 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.985 -170.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.877 HG23 HD11 ' A' ' 965' ' ' LEU . 14.4 p -60.6 -38.02 77.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.44 175.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.546 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 55.6 m -65.49 -32.85 74.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 172.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -57.82 -33.2 67.44 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 114.677 -1.147 . . . . 0.0 112.866 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.533 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 21.0 tp -62.7 -43.0 99.93 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 117.383 0.591 . . . . 0.0 109.43 174.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 937' ' ' ILE . 27.4 t -63.53 -42.08 94.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.689 176.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.581 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 10.9 mmpt? -65.27 -31.01 71.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 177.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.02 -25.14 43.27 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.479 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.64 ' HA ' HG22 ' A' ' 958' ' ' VAL . 14.7 p -81.99 -11.32 12.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 C-N-CA 119.728 -0.789 . . . . 0.0 109.228 171.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.581 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 46.5 mm -72.34 -36.19 54.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 165.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.643 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.6 mm-40 -53.15 -38.05 62.39 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.372 170.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.511 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 57.5 ttp -58.16 -45.45 87.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.793 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.611 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 48.3 m -65.46 -33.07 75.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.666 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.765 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.2 m -77.46 -37.03 52.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.986 0.898 . . . . 0.0 108.943 -177.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.2 mmtp -70.01 -29.7 66.82 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 113.901 -1.499 . . . . 0.0 111.671 -177.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 1.035 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 15.4 tt -79.49 -23.29 12.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.318 0.58 . . . . 0.0 110.462 178.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 940' ' ' SER . 84.2 mm-40 -55.27 -56.02 33.2 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 941' ' ' SER . 13.4 Cg_endo -91.31 -4.08 4.35 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.766 1.644 . . . . 0.0 115.421 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.671 ' HB3' ' HB3' ' A' ' 950' ' ' GLU . . . -129.86 162.0 56.15 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -173.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.544 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 3.2 Cg_exo -80.61 -178.83 4.7 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 124.283 3.322 . . . . 0.0 110.908 168.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.929 ' HA ' ' HD1' ' A' ' 951' ' ' TYR . 5.9 Cg_endo -47.59 -18.37 0.9 Allowed 'Trans proline' 0 C--N 1.376 1.975 0 C-N-CA 124.712 3.608 . . . . 0.0 115.689 -168.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.38 -4.18 1.73 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.335 170.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 1.035 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.1 OUTLIER -96.03 -27.87 14.9 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 173.155 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.929 ' HD1' ' HA ' ' A' ' 948' ' ' PRO . 11.1 m-85 -43.53 -47.36 7.28 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.046 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -69.75 -59.58 4.48 Favored Pre-proline 0 CA--C 1.555 1.152 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.814 177.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.046 ' HD3' HG13 ' A' ' 952' ' ' VAL . 51.2 Cg_exo -59.33 -35.92 95.66 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.338 2.026 . . . . 0.0 114.873 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.73 ' HE2' ' HA ' ' A' ' 951' ' ' TYR . 24.0 ptt? -64.01 -47.61 79.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.156 0.503 . . . . 0.0 110.38 -177.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.663 ' HB ' ' HB3' ' A' 1002 ' ' MET . 72.0 t -66.32 -27.0 39.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.55 174.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 88.2 tttt -62.71 -38.34 90.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 177.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 4.5 mm-40 -54.04 -45.37 71.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.883 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.656 ' HB ' HD21 ' A' ' 998' ' ' LEU . 1.9 t -71.71 -22.61 21.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.022 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.623 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.62 -45.79 34.37 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.109 -178.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.03 -21.61 66.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.826 0.346 . . . . 0.0 110.483 171.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 958' ' ' VAL . . . -62.34 -56.91 13.84 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.995 178.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 991' ' ' LEU . 8.3 tt -70.66 -27.26 63.9 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.195 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.58 -54.51 45.12 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.022 170.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.487 HG22 HD21 ' A' ' 928' ' ' ASN . 24.8 m -53.89 -38.55 64.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.599 174.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.877 HD11 HG23 ' A' ' 929' ' ' VAL . 0.4 OUTLIER -64.33 -29.6 70.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.418 178.695 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.423 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 34.5 tp -63.97 -31.95 73.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.507 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -64.64 -38.49 91.17 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.558 0.694 . . . . 0.0 110.045 173.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.744 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.9 m -62.99 -39.0 93.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.423 173.238 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 87.0 t -54.88 -31.73 25.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.286 174.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.531 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 0.9 OUTLIER -73.95 -23.19 59.46 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 176.62 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.637 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.4 mm-40 -67.62 -52.92 32.54 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 122.71 1.243 . . . . 0.0 109.001 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.416 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 9.6 p -66.8 -23.08 66.02 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 114.233 -1.348 . . . . 0.0 111.206 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.693 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 37.8 tp -55.76 -53.76 59.22 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-O 118.921 -0.561 . . . . 0.0 112.077 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 37.5 Cg_exo -61.09 -24.64 79.76 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.336 1.357 . . . . 0.0 111.246 170.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.691 HG12 ' HB ' ' A' ' 980' ' ' THR . 38.3 t -74.49 -13.94 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.334 174.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 1.015 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.3 tt -70.34 -53.16 10.72 Favored Pre-proline 0 C--O 1.234 0.27 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.407 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.529 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 33.9 Cg_exo -61.24 -25.5 80.71 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 121.178 1.252 . . . . 0.0 110.96 173.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.08 -64.97 0.77 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.22 174.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.833 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.4 m -163.46 -35.28 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -173.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.713 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 1.0 OUTLIER -61.47 -14.11 26.21 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -171.574 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 1.015 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 9.7 p-80 -50.15 -19.16 0.7 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -172.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.506 ' HE ' ' HA ' ' A' ' 982' ' ' ARG . 2.6 tpm_? -73.8 -52.72 12.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.58 176.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.925 ' HB3' HG13 ' A' 1038 ' ' VAL . 3.1 mp0 -77.05 -43.95 32.53 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.785 HD11 HG13 ' A' ' 969' ' ' VAL . 9.8 tp -56.97 -30.13 33.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.65 -174.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 10.5 mm-40 -73.02 -45.13 59.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.38 172.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.692 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 14.3 ptp -62.72 -54.41 39.61 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.648 -170.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.77 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -74.88 -35.55 62.3 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.14 -176.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.885 ' HA ' HD12 ' A' ' 991' ' ' LEU . 6.4 tp-100 -59.59 -40.27 86.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.716 -176.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.721 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 69.1 mmtt -61.24 -42.35 98.46 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -65.75 -38.3 88.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.468 -1.242 . . . . 0.0 111.292 179.129 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.887 ' HB3' HD11 ' A' ' 962' ' ' LEU . 21.3 mt -61.8 -47.03 86.97 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.428 0.632 . . . . 0.0 109.888 179.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -57.81 -46.18 85.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.54 -177.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.7 p -70.81 -38.2 73.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.842 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.456 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 1.2 m-20 -91.42 -42.14 10.48 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.913 0.708 . . . . 0.0 112.913 -168.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.791 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.6 tm? -59.92 -40.45 88.9 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 171.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -58.37 -51.48 69.63 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.97 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 994' ' ' ASP . 9.8 pt-20 -68.71 -28.86 67.21 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.663 178.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.843 HD22 HD13 ' A' 1028 ' ' LEU . 1.1 tp -56.97 -49.56 75.32 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.523 175.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.639 ' O ' ' HG3' ' A' 1002 ' ' MET . 29.7 pt -73.55 -24.71 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 120.849 0.356 . . . . 0.0 111.471 -179.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.69 ' O ' ' HB2' ' A' 1004 ' ' LEU . 51.4 m-80 -87.12 -1.11 57.65 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 121.96 -0.463 . . . . 0.0 109.869 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 1.0 ' HD2' ' HA ' ' A' 1021 ' ' MET . 5.5 ttpm? -82.99 -37.42 24.03 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 172.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.943 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -73.57 -37.64 65.44 Favored 'General case' 0 CA--C 1.503 -0.86 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 173.151 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 53.8 tptt -56.63 -57.84 10.64 Favored 'General case' 0 N--CA 1.435 -1.177 0 CA-C-N 114.735 -1.12 . . . . 0.0 108.37 171.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.782 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 10.7 tp -55.29 -55.26 33.49 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.4 81.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 110.723 -177.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.7 -13.26 60.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.526 0.679 . . . . 0.0 110.115 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.7 tp-100 -79.79 -31.6 40.81 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.107 178.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.567 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 67.0 t80 -118.1 17.49 14.03 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.12 -176.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.529 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 7.3 p -57.7 94.9 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 122.224 1.011 . . . . 0.0 111.322 177.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.587 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 50.3 ttm -118.25 47.79 1.53 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.063 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 15.7 m 58.76 -92.02 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.021 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 49.5 m -86.04 -30.87 22.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.661 0.267 . . . . 0.0 111.282 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.587 ' HB2' ' HB3' ' A' 1010 ' ' MET . 3.2 mm? -77.31 -9.0 58.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.223 0.535 . . . . 0.0 110.425 -178.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' 1009 ' ' VAL . 1.1 tm0? -68.52 -21.53 64.57 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.369 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.812 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 26.2 tt0 -60.55 -32.42 71.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.107 -176.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.29 -43.77 22.68 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.262 169.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.782 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 7.2 m-30 -87.07 -7.36 58.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.083 0.468 . . . . 0.0 110.495 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.812 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 30.3 tptt -75.64 -26.41 57.72 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.654 169.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 67.7 mttm -72.35 -57.24 4.36 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 174.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -47.97 -35.56 11.02 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.471 169.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 1.0 ' HA ' ' HD2' ' A' 1001 ' ' LYS . 7.9 tpt -51.68 -48.69 63.37 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.263 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.54 -53.4 23.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.647 0.26 . . . . 0.0 110.851 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 15.2 m -59.95 -46.22 90.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.124 -174.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.853 ' HB3' ' HD3' ' A' 1001 ' ' LYS . . . -74.59 -31.97 62.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.689 0.28 . . . . 0.0 111.681 -173.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.638 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -75.47 -37.54 60.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.956 0.408 . . . . 0.0 110.451 178.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . . . . . . . . . 26.5 t60 -70.38 -30.3 67.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.278 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.428 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -68.95 -34.76 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.376 176.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.843 HD13 HD22 ' A' ' 998' ' ' LEU . 0.6 OUTLIER -63.95 -42.47 97.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 122.145 0.974 . . . . 0.0 109.715 173.118 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.9 -33.56 64.75 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.349 176.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' 1027 ' ' ALA . 82.6 t -66.63 -33.77 65.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 172.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.737 ' HB2' HD23 ' A' ' 991' ' ' LEU . 1.9 p30 -72.36 -38.78 68.45 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.476 ' HB2' HD23 ' A' ' 932' ' ' LEU . . . -61.15 -44.72 96.87 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.692 171.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.651 ' O ' ' HG ' ' A' 1036 ' ' LEU . 60.0 tttm -63.76 -42.13 97.88 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.792 -176.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.599 ' O ' HG23 ' A' 1038 ' ' VAL . 66.1 t30 -73.2 -40.01 65.09 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.375 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.774 ' O ' HG12 ' A' 1039 ' ' ILE . 18.1 tp -73.76 -31.65 63.43 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.597 -177.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.84 ' HA ' HG11 ' A' ' 929' ' ' VAL . 4.3 pp -62.29 -37.02 83.92 Favored 'General case' 0 CA--C 1.503 -0.827 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 177.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.481 ' N ' HD12 ' A' 1036 ' ' LEU . 29.2 t70 -75.67 -37.92 59.18 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.386 176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.925 HG13 ' HB3' ' A' ' 983' ' ' GLU . 4.8 t -53.59 -59.07 2.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.98 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.81 HD11 ' HB ' ' A' ' 929' ' ' VAL . 3.5 pt -85.83 -24.73 6.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.153 -174.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.458 ' HB2' ' CD1' ' A' ' 926' ' ' TYR . 19.7 t70 -61.08 -39.27 89.3 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.475 162.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.719 ' O ' ' HG2' ' A' 1045 ' ' LYS . 35.7 mt-30 -68.21 -35.08 77.42 Favored 'General case' 0 C--O 1.206 -1.225 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.393 171.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.629 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.98 -49.49 71.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.122 0.487 . . . . 0.0 110.717 174.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.84 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -47.4 -41.46 20.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.624 172.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.527 ' N ' ' HD3' ' A' 1043 ' ' ARG . 26.3 tp -79.97 -32.44 39.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.278 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.833 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 31.6 mmtp -63.13 -42.18 99.46 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.325 0.583 . . . . 0.0 109.973 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 25.6 ttt -69.12 -33.65 73.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.81 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.587 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 31.6 mm -69.53 -41.86 80.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.934 173.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 70.5 m -54.38 -28.03 40.57 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.615 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.49 -45.96 9.04 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 18.9 m -61.16 -37.97 84.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.091 0.472 . . . . 0.0 110.633 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.459 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 4.9 mtp180 -80.41 122.05 82.18 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 173.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 11.3 Cg_exo -72.51 44.07 0.7 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.317 2.678 . . . . 0.0 113.075 -176.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 38.5 m-70 . . . . . 0 C--O 1.245 0.864 0 CA-C-O 118.694 -0.669 . . . . 0.0 110.439 -179.894 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.936 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 2.2 tpm_? . . . . . 0 N--CA 1.449 -0.495 0 CA-C-O 120.742 0.306 . . . . 0.0 110.57 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.403 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 38.3 m -123.59 46.14 2.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.684 -174.199 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 44.9 55.95 5.69 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.881 0.872 . . . . 0.0 112.934 173.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.612 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 23.8 t0 -47.8 -175.05 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.717 0 O-C-N 125.399 1.687 . . . . 0.0 111.845 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.491 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.2 tmtm? -37.0 -21.02 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.12 0.968 . . . . 0.0 112.874 -179.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.887 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 6.9 m -59.69 -51.44 72.7 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.886 0 O-C-N 122.144 -0.348 . . . . 0.0 111.299 173.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 27.4 t80 -75.63 -31.89 60.03 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 -173.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.76 -58.07 7.23 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 113.874 -1.512 . . . . 0.0 111.651 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -70.6 -30.43 67.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.123 -173.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.673 HG22 HD11 ' A' ' 965' ' ' LEU . 61.2 t -66.19 -41.32 89.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 119.973 -0.691 . . . . 0.0 109.884 175.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.686 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 67.3 m -60.19 -35.86 76.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 169.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -59.52 -33.96 79.1 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.021 -0.99 . . . . 0.0 112.519 174.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.709 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 5.3 tt -63.7 -45.9 87.92 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.8 t -57.09 -42.54 79.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.915 176.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.686 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.5 mmpt? -63.71 -40.85 97.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.418 178.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.717 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -79.16 -26.55 42.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.959 -177.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' A' ' 939' ' ' MET . 15.0 p -79.01 -14.53 13.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.697 0.761 . . . . 0.0 109.128 172.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 24.4 mm -69.83 -31.43 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 167.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.568 ' HG3' ' HA ' ' A' ' 935' ' ' ALA . 36.2 mt-10 -61.27 -39.05 88.97 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.939 174.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.749 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 43.6 ttp -51.37 -47.06 62.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.334 172.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.621 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 22.9 t -71.9 -39.18 69.74 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.048 178.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.453 ' HA ' HE21 ' A' ' 944' ' ' GLN . 46.7 m -71.71 -50.88 26.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.159 0.504 . . . . 0.0 110.564 -169.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.631 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -82.98 -11.48 58.1 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.74 -0.663 . . . . 0.0 111.566 -173.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -77.17 -45.79 29.58 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.212 0.46 . . . . 0.0 111.378 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 940' ' ' SER . 0.1 OUTLIER -59.05 -46.81 99.42 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -173.349 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.609 ' HD3' ' HG3' ' A' ' 944' ' ' GLN . 79.2 Cg_endo -87.96 16.08 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.438 1.425 . . . . 0.0 113.545 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.696 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -125.72 154.26 73.15 Favored Pre-proline 0 C--N 1.328 -0.364 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.39 175.27 10.91 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 123.157 2.571 . . . . 0.0 111.821 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.966 ' HB3' HE21 ' A' 1006 ' ' GLN . 88.7 Cg_exo -50.24 -35.39 43.22 Favored 'Trans proline' 0 C--O 1.248 0.998 0 C-N-CA 123.118 2.545 . . . . 0.0 113.121 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -55.18 -25.27 31.45 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.857 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.696 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 53.3 mm-40 -106.94 -3.16 20.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.922 -179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.732 ' O ' ' HG3' ' A' ' 954' ' ' MET . 9.7 m-30 -61.31 -47.31 86.54 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 173.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.928 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -71.58 -44.01 12.2 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.876 177.019 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.928 ' HD3' HG13 ' A' ' 952' ' ' VAL . 88.5 Cg_exo -55.02 -29.72 66.34 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 121.805 1.67 . . . . 0.0 115.239 171.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 0.0 OUTLIER -72.95 -30.69 64.05 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.968 0.889 . . . . 0.0 109.644 178.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.784 HG11 ' HA ' ' A' ' 999' ' ' ILE . 0.6 OUTLIER -71.37 -26.2 26.31 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.003 174.455 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.651 ' HE3' ' HA ' ' A' ' 953' ' ' PRO . 8.6 mtmp? -58.15 -38.53 76.76 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.438 175.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.427 ' H ' ' HG2' ' A' ' 957' ' ' GLU . 1.1 mm-40 -55.59 -45.98 77.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.711 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.507 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 2.2 t -65.42 -32.77 59.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.002 0.43 . . . . 0.0 110.788 175.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.79 -41.67 97.46 Favored Glycine 0 C--O 1.228 -0.232 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.775 177.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 62.6 tp -68.91 -33.47 73.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.242 0.544 . . . . 0.0 109.653 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.717 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -53.64 -57.07 12.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.766 177.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.953 HD22 ' HG ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -74.68 -21.13 59.57 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.578 -179.497 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -53.84 13.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.831 0.348 . . . . 0.0 110.322 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 7.0 m -58.22 -27.81 64.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.907 0.861 . . . . 0.0 109.488 173.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.673 HD11 HG22 ' A' ' 929' ' ' VAL . 17.4 tp -70.76 -37.27 73.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.889 178.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -51.01 -33.39 24.77 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.594 -0.276 . . . . 0.0 110.882 172.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -62.5 -48.84 77.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.798 0.332 . . . . 0.0 110.413 173.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.768 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.6 m -58.35 -46.1 86.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.306 173.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.794 HG13 HD11 ' A' ' 984' ' ' ILE . 96.6 t -52.43 -30.25 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.968 175.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.443 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 24.4 t70 -70.98 -29.06 64.94 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.289 178.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.623 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 34.5 mm-40 -65.57 -57.04 9.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 122.53 1.157 . . . . 0.0 109.036 172.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.492 ' O ' ' HB ' ' A' ' 975' ' ' VAL . 53.0 p -58.5 -22.98 56.86 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.0 -1.0 . . . . 0.0 113.065 174.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.668 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 43.0 tp -56.83 -54.24 56.28 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.556 -179.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.668 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 52.3 Cg_exo -57.91 -23.71 60.95 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 121.6 1.533 . . . . 0.0 111.648 168.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.58 HG12 ' HB ' ' A' ' 980' ' ' THR . 44.0 t -74.89 -16.22 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.815 175.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 984' ' ' ILE . 1.0 OUTLIER -69.01 -48.08 28.74 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 118.973 -0.537 . . . . 0.0 111.641 176.688 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.528 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 39.9 Cg_exo -60.5 -26.51 82.96 Favored 'Trans proline' 0 C--N 1.358 1.038 0 C-N-CA 121.156 1.237 . . . . 0.0 111.103 170.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.631 ' HA ' ' OE1' ' A' 1049 ' ' GLN . . . -70.42 -66.6 0.58 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.803 176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.832 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.0 m -165.46 -27.27 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -174.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.663 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 2.8 t -65.13 -12.81 54.97 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -172.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.551 ' CD2' ' HG3' ' A' ' 985' ' ' GLU . 3.7 t60 -45.8 -44.5 14.11 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 122.761 0.424 . . . . 0.0 111.621 -169.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -55.18 -53.53 54.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.038 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.0 OUTLIER -75.2 -43.45 51.88 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.794 HD11 HG13 ' A' ' 969' ' ' VAL . 11.3 tp -62.64 -26.62 41.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.297 -175.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.551 ' HG3' ' CD2' ' A' ' 981' ' ' HIS . 1.3 mm-40 -74.08 -38.32 63.93 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.366 171.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.707 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 12.1 ptp -66.19 -62.44 1.48 Allowed 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 119.738 -0.785 . . . . 0.0 111.175 -174.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.705 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.23 -36.61 39.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 -173.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.673 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 0.5 OUTLIER -69.47 -43.14 73.81 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.56 -175.064 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -66.36 -27.66 68.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.511 0.672 . . . . 0.0 109.244 173.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.559 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.8 tp -72.01 -39.92 68.86 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.494 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.852 HD11 HD22 ' A' 1035 ' ' LEU . 29.1 mt -59.76 -61.14 2.84 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.588 178.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -47.17 -37.8 10.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.113 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 71.0 m -67.43 -57.57 6.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.661 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.603 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 3.7 m-20 -93.66 -15.99 24.75 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.953 ' HG ' HD22 ' A' ' 962' ' ' LEU . 2.5 tm? -61.22 -50.6 72.41 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.626 1.103 . . . . 0.0 108.338 163.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.775 ' O ' ' HB3' ' A' 1000 ' ' ASN . . . -52.9 -30.73 35.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.544 172.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.71 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.8 tp10 -64.32 -45.24 88.75 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.551 HD21 ' O ' ' A' 1024 ' ' ALA . 4.1 mm? -77.54 -50.39 12.69 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.51 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.784 ' HA ' HG11 ' A' ' 955' ' ' VAL . 15.6 tt -57.0 -21.03 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 CA-C-O 121.696 0.76 . . . . 0.0 110.773 -178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.775 ' HB3' ' O ' ' A' ' 996' ' ' ALA . 0.6 OUTLIER -109.44 -22.19 12.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.578 -173.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.71 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 9.0 tptm -84.48 -36.45 22.26 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 123.126 0.266 . . . . 0.0 111.029 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 0.3 OUTLIER -78.69 -36.07 44.13 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 174.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.853 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.2 ttpt -58.73 -37.59 76.5 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 167.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.707 ' HB2' ' O ' ' A' 1000 ' ' ASN . 8.4 tt -68.85 -50.13 52.49 Favored 'General case' 0 C--O 1.214 -0.776 0 O-C-N 123.774 0.671 . . . . 0.0 110.295 -176.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' 1017 ' ' TYR . . . -55.55 -46.39 77.13 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.804 0.811 . . . . 0.0 109.959 179.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.966 HE21 ' HB3' ' A' ' 948' ' ' PRO . 0.9 OUTLIER -76.19 -13.54 60.18 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.777 -178.707 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.853 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.5 OUTLIER -95.96 -40.42 9.29 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.412 0.625 . . . . 0.0 111.593 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 51.3 t80 -89.51 1.98 55.18 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.803 -176.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.706 HG23 ' HG3' ' A' 1014 ' ' GLN . 5.9 p -30.4 125.08 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 113.73 -1.577 . . . . 0.0 114.313 -179.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.467 ' SD ' HD22 ' A' 1013 ' ' LEU . 41.5 ttm -133.22 148.2 52.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.228 -1.351 . . . . 0.0 108.669 171.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 8.0 m -51.0 112.25 0.69 Allowed 'General case' 0 C--N 1.326 -0.414 0 O-C-N 123.391 0.432 . . . . 0.0 111.345 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 t 75.24 -41.52 0.46 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.877 0.871 . . . . 0.0 112.238 176.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.467 HD22 ' SD ' ' A' 1010 ' ' MET . 8.8 mp -72.38 -8.44 54.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.706 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -54.58 -41.05 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.521 178.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -59.17 -25.79 64.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.004 -172.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -54.52 -58.5 7.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.35 0.595 . . . . 0.0 109.847 173.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.604 ' HB2' ' HA ' ' A' 1005 ' ' ALA . 0.1 OUTLIER -55.0 -33.14 62.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.539 177.759 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . . . . . . . . . 58.2 tttm -71.38 -45.47 62.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.904 -177.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.62 -27.97 64.47 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.857 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -59.91 -44.08 94.49 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 170.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.533 ' HG3' ' HB2' ' A' 1002 ' ' MET . 1.7 tmt? -61.82 -42.08 98.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.581 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.91 -39.04 76.97 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.162 0.506 . . . . 0.0 110.784 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 31.4 m -69.57 -46.74 65.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.149 177.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.551 ' O ' HD21 ' A' ' 998' ' ' LEU . . . -60.67 -36.09 77.86 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.543 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.488 ' N ' HD11 ' A' ' 998' ' ' LEU . . . -59.04 -35.8 73.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.086 0.47 . . . . 0.0 110.754 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.587 ' O ' HG23 ' A' 1030 ' ' VAL . 16.2 t-160 -67.31 -31.7 72.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.78 177.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.501 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -72.35 -55.74 6.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.062 -178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.933 HD22 ' HA ' ' A' ' 995' ' ' LEU . 24.5 tp -58.74 -35.85 73.38 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.046 0.451 . . . . 0.0 111.531 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.41 -36.93 66.99 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.879 0.371 . . . . 0.0 111.548 170.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' 1026 ' ' HIS . 82.6 t -64.14 -36.18 76.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.732 175.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.603 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 11.0 m-20 -60.59 -44.56 96.11 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.982 0.42 . . . . 0.0 110.486 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.538 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -59.52 -54.0 51.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.514 174.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -53.37 -38.29 63.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' 1038 ' ' VAL . 54.0 t30 -71.58 -54.02 11.85 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.186 -178.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.852 HD22 HD11 ' A' ' 991' ' ' LEU . 15.0 tp -57.52 -33.19 67.81 Favored 'General case' 0 C--O 1.213 -0.837 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.885 179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.581 ' N ' HG11 ' A' ' 929' ' ' VAL . 38.7 tp -52.62 -47.29 67.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.857 0.837 . . . . 0.0 109.842 176.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.3 t70 -68.51 -42.15 78.94 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.355 174.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.038 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.0 t -52.97 -61.91 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.459 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.781 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.887 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -82.45 -30.2 9.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.777 ' H ' HD12 ' A' 1039 ' ' ILE . 44.1 t0 -56.88 -37.49 71.45 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 165.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' 1045 ' ' LYS . 2.7 mp0 -73.15 -36.56 66.68 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-N 114.536 -1.211 . . . . 0.0 109.63 172.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.664 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.49 -52.44 59.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.24 0.543 . . . . 0.0 111.232 176.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.936 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 0.3 OUTLIER -58.83 -31.0 68.08 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.94 179.198 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.651 HD12 ' HB3' ' A' ' 920' ' ' ARG . 11.1 mp -77.88 -31.85 51.59 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.943 -0.117 . . . . 0.0 111.22 171.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.832 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 32.9 mmtp -59.87 -36.93 77.94 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.812 0.815 . . . . 0.0 108.915 175.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 42.2 ttp -69.22 -36.81 77.61 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.473 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' 1051 ' ' ARG . 48.6 mm -64.69 -42.45 95.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.539 172.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 37.3 m -55.98 -46.61 78.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.841 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.631 ' OE1' ' HA ' ' A' ' 978' ' ' ALA . 24.9 tt0 -59.46 -55.71 31.16 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.575 0.226 . . . . 0.0 111.581 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 33.8 t -159.46 -9.34 0.06 Allowed 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.657 -0.417 . . . . 0.0 112.066 -175.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.549 ' HA ' ' HA ' ' A' 1047 ' ' ILE . 16.5 ttp180 59.8 99.14 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.793 -175.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -56.8 125.96 20.71 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.014 2.476 . . . . 0.0 113.236 -176.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 16.3 p80 . . . . . 0 C--O 1.248 0.974 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.635 176.984 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.978 ' HG3' ' HB2' ' A' 1043 ' ' ARG . 3.4 mmp_? . . . . . 0 N--CA 1.469 0.521 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 32.4 t 63.19 16.52 9.46 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -166.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.471 ' O ' ' O ' ' A' ' 923' ' ' ASP . 1.3 m120 55.65 72.33 0.49 Allowed 'General case' 0 CA--C 1.498 -1.047 0 CA-C-N 114.326 -1.307 . . . . 0.0 109.602 -174.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' A' ' 925' ' ' VAL . 4.8 t70 -46.63 -174.75 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.532 0 O-C-N 126.299 2.249 . . . . 0.0 113.074 -168.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.601 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 3.1 tmtm? -46.9 -8.05 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.731 0.812 . . . . 0.0 112.307 -176.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.735 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 0.0 OUTLIER -72.26 -49.76 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 C-N-CA 122.704 0.402 . . . . 0.0 110.896 174.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 14.9 t80 -73.3 -25.81 60.81 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.111 0.958 . . . . 0.0 108.416 -178.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.431 ' O ' ' HB ' ' A' ' 930' ' ' THR . 97.1 mt-10 -73.54 -57.4 4.02 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.333 -177.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -66.49 -32.79 74.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.491 -171.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 1.079 HG11 ' HA ' ' A' 1036 ' ' LEU . 12.2 p -67.38 -40.97 85.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.789 177.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.59 HG22 ' HD2' ' A' ' 934' ' ' LYS . 59.6 m -53.8 -31.99 51.0 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.821 0.343 . . . . 0.0 110.694 166.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . 0.508 ' HA2' ' HB2' ' A' ' 934' ' ' LYS . . . -66.99 -31.97 79.52 Favored Glycine 0 C--O 1.227 -0.307 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 176.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 1.033 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.57 -51.06 70.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 173.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.677 ' O ' HG12 ' A' ' 937' ' ' ILE . 46.5 t -60.87 -31.37 49.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-O 121.275 0.56 . . . . 0.0 110.906 174.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.59 ' HD2' HG22 ' A' ' 930' ' ' THR . 0.0 OUTLIER -72.13 -43.53 64.55 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.008 -178.572 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 1.025 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -75.83 -25.26 56.11 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 122.201 -0.312 . . . . 0.0 111.349 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.623 ' HA ' HG12 ' A' ' 958' ' ' VAL . 7.5 p -75.87 -13.05 14.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 119.636 -0.825 . . . . 0.0 109.644 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.677 HG12 ' O ' ' A' ' 933' ' ' VAL . 37.4 mm -71.11 -31.04 43.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 168.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 12.2 mm-40 -57.88 -40.71 80.88 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 171.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.467 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 47.6 ttp -56.47 -45.22 81.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.572 177.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.48 ' O ' HG22 ' A' ' 943' ' ' ILE . 16.2 p -73.19 -31.54 64.27 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -178.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.626 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 8.0 p -78.5 -40.8 34.23 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -177.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.503 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 4.4 mmtp -52.37 -47.16 66.34 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.47 174.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.603 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 16.5 tt -70.67 -22.35 23.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.522 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.828 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 32.9 mm-40 -55.68 -61.98 5.33 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.579 178.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 12.2 Cg_endo -92.92 -31.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 121.833 1.689 . . . . 0.0 114.086 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 950' ' ' GLU . . . -83.82 150.41 58.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 121.218 0.532 . . . . 0.0 112.371 -169.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.587 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 72.6 Cg_endo -83.87 -177.83 3.28 Favored 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 123.371 2.714 . . . . 0.0 113.156 -177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.587 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 4.8 Cg_endo -49.3 -36.57 38.14 Favored 'Trans proline' 0 C--O 1.255 1.365 0 C-N-CA 124.245 3.297 . . . . 0.0 113.96 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -55.06 -20.17 8.99 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.664 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.626 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 61.4 mm-40 -107.71 -4.96 17.67 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.944 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.591 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.9 m-30 -57.61 -42.19 82.75 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.49 -46.87 3.3 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 119.181 -1.007 . . . . 0.0 112.531 177.347 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 78.2 Cg_exo -57.49 -29.45 84.78 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.562 1.508 . . . . 0.0 114.676 171.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.603 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 19.6 ptp -73.81 -31.88 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.446 0.641 . . . . 0.0 109.868 179.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.727 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -72.29 -25.6 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.325 174.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 17.9 tppt? -58.57 -41.68 86.22 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 173.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.99 -45.82 68.01 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.884 175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 0.9 OUTLIER -66.69 -29.71 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.022 178.119 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.545 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -67.4 -41.69 90.57 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.91 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.72 -40.6 88.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 109.901 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 1.033 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -48.45 -57.48 6.04 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 173.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.756 ' HB2' HD13 ' A' ' 995' ' ' LEU . 5.2 tt -70.52 -28.9 65.3 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 119.162 -1.015 . . . . 0.0 111.651 177.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -56.8 -57.24 13.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.701 0.286 . . . . 0.0 110.746 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 1.7 p -58.57 -44.55 89.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.18 0.514 . . . . 0.0 110.365 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 57.1 tp -51.1 -41.58 60.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.133 175.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 73.8 mt -54.82 -36.52 65.07 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.93 93.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.972 0.415 . . . . 0.0 109.978 175.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.684 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -63.85 -38.94 92.97 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.016 173.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 82.0 t -54.79 -31.9 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 O-C-N 122.235 -0.291 . . . . 0.0 110.802 172.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.509 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 2.7 m-20 -73.03 -22.48 60.63 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.757 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.5 mm-40 -74.23 -44.35 53.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 122.176 0.988 . . . . 0.0 108.638 171.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.503 ' OG ' HG21 ' A' ' 980' ' ' THR . 32.8 t -69.2 -24.13 63.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.892 177.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.719 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 55.7 tp -59.91 -50.68 85.33 Favored Pre-proline 0 C--O 1.218 -0.58 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.505 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 11.5 Cg_endo -61.12 -26.17 82.22 Favored 'Trans proline' 0 C--N 1.355 0.908 0 CA-C-N 121.424 1.544 . . . . 0.0 110.927 170.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.9 t -77.15 -11.08 13.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 119.763 -0.775 . . . . 0.0 110.222 174.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 1.9 tt -69.16 -53.23 14.07 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.62 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.462 ' N ' HD23 ' A' ' 976' ' ' LEU . 45.0 Cg_endo -69.44 -19.46 37.61 Favored 'Trans proline' 0 C--N 1.358 1.048 0 CA-C-N 120.457 1.199 . . . . 0.0 110.933 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -67.97 -55.31 13.2 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.694 172.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.703 ' HB3' ' HG3' ' A' 1045 ' ' LYS . 31.1 m -166.11 -35.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -175.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.789 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.4 m -64.17 -18.43 64.47 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -168.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.772 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 11.6 t-160 -48.81 -26.43 2.39 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -172.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -72.2 -56.1 6.12 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 119.739 -0.784 . . . . 0.0 111.383 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.743 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -73.11 -42.65 62.7 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.789 ' HB ' HG22 ' A' ' 980' ' ' THR . 12.0 tt -58.76 -30.94 43.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.195 -174.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -72.68 -37.73 67.8 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.285 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.609 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 13.6 ptp -67.23 -59.06 3.74 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.629 -176.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.825 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -68.41 -45.57 72.28 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 1.128 ' HA ' HD12 ' A' ' 991' ' ' LEU . 6.1 tt0 -58.23 -44.32 88.19 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.616 -175.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -61.6 -33.88 74.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.424 0.63 . . . . 0.0 109.933 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.65 -42.55 61.22 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.469 178.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.128 HD12 ' HA ' ' A' ' 988' ' ' GLN . 14.5 mt -53.43 -58.13 8.2 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.116 0.484 . . . . 0.0 110.653 174.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -45.65 -48.15 14.88 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.184 -178.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 4.5 p -73.06 -47.62 43.07 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.011 -176.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.482 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.1 m-20 -82.09 -38.67 24.51 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -170.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.807 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -56.26 -60.21 3.83 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.623 0.647 . . . . 0.0 109.798 170.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -56.45 -23.46 38.96 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.899 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 993' ' ' SER . 20.5 tt0 -70.56 -43.24 69.89 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 119.297 -0.961 . . . . 0.0 108.554 177.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.634 ' HA ' ' HB1' ' A' 1024 ' ' ALA . 0.3 OUTLIER -60.84 -47.54 85.87 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.628 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 77.7 mt -55.63 -68.55 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.381 -179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.824 ' O ' ' HB2' ' A' 1004 ' ' LEU . 0.0 OUTLIER -54.05 -18.91 4.06 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 114.395 -1.275 . . . . 0.0 113.108 177.897 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.64 ' HG3' ' HB2' ' A' 1024 ' ' ALA . 24.6 mmtp -85.26 -37.69 19.74 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.873 0.761 . . . . 0.0 111.395 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 998' ' ' LEU . 57.2 mtp -79.18 -34.78 42.78 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.652 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.9 tttm -63.54 -40.94 98.33 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 113.568 -1.651 . . . . 0.0 108.699 170.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.824 ' HB2' ' O ' ' A' 1000 ' ' ASN . 15.3 tp -60.77 -46.82 88.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.041 173.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -58.97 -45.18 91.18 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.6 0.714 . . . . 0.0 109.989 176.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -77.12 -6.58 53.42 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.261 177.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' 1003 ' ' LYS . 3.2 tp-100 -91.09 -22.46 20.71 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.349 -0.842 . . . . 0.0 109.319 175.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 64.6 t80 -121.45 20.08 11.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.48 -176.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.564 HG23 ' HG3' ' A' 1014 ' ' GLN . 5.6 p -61.18 88.7 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 122.196 0.998 . . . . 0.0 110.706 176.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.665 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 11.0 tpt -121.2 67.79 0.88 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.819 -177.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 9.7 m 61.36 -89.44 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.001 177.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.3 t -105.53 -8.6 17.93 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 -177.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.665 ' HB2' ' HB3' ' A' 1010 ' ' MET . 87.5 mt -82.31 -9.08 59.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.287 0.565 . . . . 0.0 110.174 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.842 HE22 ' HB2' ' A' 1018 ' ' LYS . 1.0 OUTLIER -67.06 -45.9 75.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.698 -175.556 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.542 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 9.5 tt0 -53.59 -36.08 61.56 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.37 -59.3 4.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.116 0.484 . . . . 0.0 111.44 175.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.687 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.1 m-30 -62.27 -35.74 79.93 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.858 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.842 ' HB2' HE22 ' A' 1014 ' ' GLN . 86.2 tttt -55.63 -39.35 70.7 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.575 172.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.431 ' HD2' HD12 ' A' 1022 ' ' LEU . 26.5 tptp -68.29 -44.19 76.01 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -57.73 -33.08 68.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.96 174.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.737 ' HG2' ' O ' ' A' 1018 ' ' LYS . 9.0 ptt? -75.34 -25.66 57.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' 1018 ' ' LYS . 94.1 mt -71.15 -38.07 72.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.009 0.433 . . . . 0.0 109.857 175.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 98.9 m -59.76 -41.39 90.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.066 -0.515 . . . . 0.0 109.994 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.64 ' HB2' ' HG3' ' A' 1001 ' ' LYS . . . -64.79 -38.39 90.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.159 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -62.6 -38.62 90.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.117 0.484 . . . . 0.0 110.457 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.538 ' O ' HG23 ' A' 1030 ' ' VAL . 4.6 t-160 -68.78 -39.38 80.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.47 174.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.482 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -63.77 -51.64 63.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.782 -177.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.807 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.2 OUTLIER -60.79 -43.87 97.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.868 178.213 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.536 ' N ' HD23 ' A' 1028 ' ' LEU . . . -53.6 -28.3 31.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.819 173.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 1026 ' ' HIS . 88.5 t -72.4 -45.71 59.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 121.221 -0.192 . . . . 0.0 110.736 174.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.769 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.3 p30 -64.49 -47.27 79.58 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.632 178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' 1036 ' ' LEU . . . -52.96 -29.08 26.82 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 170.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.458 ' O ' HD12 ' A' 1036 ' ' LEU . 35.7 ttpt -83.49 -48.77 9.94 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.451 0.644 . . . . 0.0 109.308 -176.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.539 ' O ' HG23 ' A' 1038 ' ' VAL . 2.2 t30 -61.54 -47.97 83.13 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.349 -176.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.864 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 12.6 tp -67.75 -33.22 74.42 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.798 -177.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 1.079 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -58.28 -27.43 64.03 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.543 0.687 . . . . 0.0 109.66 177.535 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' A' 1041 ' ' GLN . 26.0 t0 -92.09 -34.49 14.35 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.636 -1.165 . . . . 0.0 108.694 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.864 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 21.7 t -63.62 -53.32 46.42 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.477 0 CA-C-N 115.423 -0.808 . . . . 0.0 113.108 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.794 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.1 pt -82.01 -30.49 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 122.432 -0.168 . . . . 0.0 111.228 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.913 ' O ' ' HD3' ' A' 1043 ' ' ARG . 19.9 t0 -53.78 -29.78 41.75 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 118.532 -1.267 . . . . 0.0 110.662 157.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.591 ' HG3' ' O ' ' A' 1037 ' ' ASP . 58.9 mt-30 -81.46 -28.73 34.01 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 120.372 -1.455 . . . . 0.0 109.742 169.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.616 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.18 -52.94 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.823 0.344 . . . . 0.0 110.843 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.978 ' HB2' ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -62.34 -33.14 74.12 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 177.118 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.512 ' O ' ' HB ' ' A' 1047 ' ' ILE . 3.7 tp -79.08 -22.4 45.32 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.53 -0.731 . . . . 0.0 110.493 175.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.703 ' HG3' ' HB3' ' A' ' 979' ' ' SER . 13.7 mptt -62.75 -37.0 84.86 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 166.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.434 ' HB3' ' O ' ' A' 1043 ' ' ARG . 22.9 ttt -67.96 -36.11 79.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.373 174.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.512 ' HB ' ' O ' ' A' 1044 ' ' LEU . 27.9 mm -60.65 -43.98 96.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.91 172.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.591 ' HB3' ' O ' ' A' 1045 ' ' LYS . 35.9 t -47.75 -38.06 14.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.492 174.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -91.82 -53.36 4.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.629 0.252 . . . . 0.0 111.295 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.465 ' OG ' ' HB2' ' A' 1053 ' ' HIS . 26.1 t -128.41 77.42 1.77 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.161 0.505 . . . . 0.0 110.632 -177.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.659 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 58.1 ttt180 -66.53 -56.87 13.72 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.307 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.659 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 16.9 Cg_exo -67.9 -18.8 46.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.216 1.944 . . . . 0.0 113.055 -174.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.465 ' HB2' ' OG ' ' A' 1050 ' ' SER . 28.7 m170 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.296 -0.859 . . . . 0.0 109.942 -177.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.93 ' HB3' ' HG2' ' A' 1043 ' ' ARG . 7.4 tpt180 . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 8.1 p -80.45 39.22 0.45 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -176.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.698 ' HA ' ' HG3' ' A' 1043 ' ' ARG . 0.4 OUTLIER 47.93 56.81 6.73 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.047 0.939 . . . . 0.0 112.339 172.869 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 925' ' ' VAL . 5.0 p-10 -47.24 -171.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 O-C-N 125.946 2.029 . . . . 0.0 113.632 -175.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.615 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 4.3 tmtp? -42.04 -8.54 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.568 1.147 . . . . 0.0 113.403 -177.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 1.04 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 2.7 m -73.4 -53.81 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 O-C-N 122.078 -0.389 . . . . 0.0 110.9 174.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.522 ' HD1' ' HB2' ' A' 1040 ' ' ASP . 62.3 t80 -76.69 -28.81 56.05 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-O 122.055 0.931 . . . . 0.0 108.829 -172.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 930' ' ' THR . 5.3 mm-40 -74.91 -52.27 11.67 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.522 -177.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.615 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 58.1 t30 -73.35 -31.04 63.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -173.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.971 HG11 HD11 ' A' 1039 ' ' ILE . 11.5 p -65.03 -42.22 94.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.596 175.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.675 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 73.6 m -52.0 -30.48 25.38 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-O 120.718 0.294 . . . . 0.0 110.495 166.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -60.83 -31.61 76.47 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.196 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.868 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 1.3 tt -66.92 -41.76 86.53 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 175.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 937' ' ' ILE . 40.1 t -63.89 -32.99 59.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.203 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' A' ' 930' ' ' THR . 11.2 mmpt? -73.84 -31.18 63.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.37 0.605 . . . . 0.0 109.434 179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.59 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -77.98 -30.39 50.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.141 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 933' ' ' VAL . 11.5 p -79.15 -12.73 13.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 175.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.646 HG12 ' O ' ' A' ' 933' ' ' VAL . 40.1 mm -70.1 -38.73 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 165.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.525 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 43.5 mt-10 -61.26 -44.86 96.56 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.416 172.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.586 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 25.2 ttt -56.88 -45.56 82.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.703 176.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 13.7 t -66.45 -34.03 77.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.61 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.657 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 47.6 m -76.46 -28.59 56.59 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 122.081 0.943 . . . . 0.0 109.245 -177.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.577 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 20.4 mmtm -69.7 -62.31 1.43 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.222 176.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.829 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -59.62 -31.78 47.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.401 -167.689 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.731 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 50.6 mt-30 -73.89 -64.24 0.78 Allowed Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.337 -175.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.8 Cg_endo -90.29 14.73 2.01 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.151 1.234 . . . . 0.0 114.675 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 942' ' ' LYS . . . -127.51 153.61 77.43 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 121.875 -0.516 . . . . 0.0 111.164 175.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.511 ' HB2' ' OE1' ' A' ' 949' ' ' GLU . 4.2 Cg_exo -81.02 176.22 9.12 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.637 2.891 . . . . 0.0 112.629 -177.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.709 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 81.6 Cg_exo -50.97 -32.26 37.6 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.755 2.97 . . . . 0.0 114.792 -177.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.511 ' OE1' ' HB2' ' A' ' 947' ' ' PRO . 1.8 pm0 -55.65 -32.17 62.98 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.904 175.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.592 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER -91.97 -1.91 57.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 176.549 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.749 ' O ' ' HG2' ' A' ' 954' ' ' MET . 14.6 m-30 -65.83 -32.89 74.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.992 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.17 -51.61 2.67 Favored Pre-proline 0 CA--C 1.554 1.111 0 C-N-CA 119.129 -1.028 . . . . 0.0 112.046 173.204 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.992 ' HD3' HG13 ' A' ' 952' ' ' VAL . 81.1 Cg_exo -52.99 -30.3 48.17 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 122.167 1.911 . . . . 0.0 114.897 170.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.829 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 24.2 ptt? -65.25 -42.29 93.46 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.633 0.73 . . . . 0.0 109.739 179.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.573 ' HB ' ' HB3' ' A' 1002 ' ' MET . 79.0 t -73.62 -26.3 21.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.913 175.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.6 OUTLIER -53.32 -45.75 69.15 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.872 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 3.8 mm-40 -55.13 -48.59 73.45 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.981 177.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.484 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 4.1 m -74.01 -28.34 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.494 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -72.49 -43.53 44.56 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.646 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.458 HD23 ' HD3' ' A' ' 956' ' ' LYS . 4.3 mm? -62.33 -38.74 90.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.185 -0.508 . . . . 0.0 109.674 172.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.868 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -50.18 -55.85 13.46 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 171.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 2.4 tm? -66.43 -34.86 78.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.111 0.414 . . . . 0.0 110.621 179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -56.84 -53.35 58.91 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 122.109 -0.369 . . . . 0.0 111.254 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.442 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 26.3 m -64.35 -40.15 95.29 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.301 0.572 . . . . 0.0 110.126 177.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 23.5 tp -53.11 -39.69 63.61 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.562 172.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.81 -27.7 63.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -65.11 -42.49 93.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 171.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.629 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 2.3 m -61.06 -40.98 95.7 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.729 171.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.785 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -54.49 -30.62 21.89 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.446 174.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.642 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 29.5 t70 -75.89 -26.87 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.512 0.196 . . . . 0.0 111.161 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 975' ' ' VAL . 19.4 mm-40 -70.77 -48.65 53.21 Favored 'General case' 0 C--O 1.247 0.921 0 CA-C-O 122.707 1.242 . . . . 0.0 107.943 173.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.541 ' OG ' HG21 ' A' ' 980' ' ' THR . 35.3 t -69.58 -22.98 63.48 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 114.361 -1.291 . . . . 0.0 110.313 178.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 1.087 ' HA ' HD13 ' A' ' 976' ' ' LEU . 1.7 tm? -54.43 -55.29 38.98 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.593 -177.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.642 ' HD2' ' O ' ' A' ' 970' ' ' ASP . 9.3 Cg_endo -58.05 -26.8 77.01 Favored 'Trans proline' 0 C--N 1.358 1.034 0 CA-C-N 120.749 1.303 . . . . 0.0 110.682 170.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 971' ' ' GLU . 3.6 t -76.0 -16.28 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.62 175.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 1.087 HD13 ' HA ' ' A' ' 973' ' ' LEU . 10.8 mp -58.87 -61.37 7.9 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-O 118.983 -0.532 . . . . 0.0 110.553 173.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.628 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 50.5 Cg_exo -57.05 -31.31 89.82 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 121.68 1.587 . . . . 0.0 111.539 178.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' 1049 ' ' GLN . . . -61.02 -54.78 40.7 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.77 174.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.818 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.5 m -171.11 -37.8 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -176.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.653 HG22 ' HB ' ' A' ' 984' ' ' ILE . 25.2 m -59.27 -22.09 60.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -170.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.589 ' HA ' HG22 ' A' ' 984' ' ' ILE . 0.9 OUTLIER -52.66 -20.48 3.12 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -173.085 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -70.51 -55.94 7.75 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.738 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.04 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.7 OUTLIER -75.23 -42.87 54.37 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.98 HD13 HD11 ' A' ' 976' ' ' LEU . 18.6 tt -60.85 -36.4 71.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 119.025 -1.07 . . . . 0.0 109.047 -173.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.3 mm-40 -59.42 -40.63 87.32 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 119.969 -0.693 . . . . 0.0 111.488 171.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.613 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 8.1 ptp -68.07 -63.25 1.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.588 -177.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.741 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.12 -33.47 50.48 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -173.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 984' ' ' ILE . 24.4 tm0? -71.51 -41.43 69.24 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 119.383 0.992 . . . . 0.0 110.0 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -71.14 -23.03 62.0 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.625 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 5.3 tp -70.11 -48.79 56.08 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.092 175.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 987' ' ' ALA . 79.7 mt -53.6 -43.29 68.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.013 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -50.57 -39.13 48.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.539 173.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 35.8 t -77.34 -50.32 13.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.595 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.443 ' CG ' ' HA ' ' A' ' 991' ' ' LEU . 1.8 p30 -72.59 -39.66 67.18 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -174.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.494 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.0 tm? -56.88 -48.15 78.84 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 171.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.781 ' HA ' HG12 ' A' ' 999' ' ' ILE . . . -52.12 -26.48 11.35 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 171.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.668 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 5.2 mm-40 -79.08 -34.91 43.21 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.525 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.875 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 10.3 mp -80.22 -32.09 38.51 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.857 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.781 HG12 ' HA ' ' A' ' 996' ' ' ALA . 44.3 pt -68.94 -20.42 24.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 C-N-CA 119.486 -0.886 . . . . 0.0 109.779 175.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.668 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 1.6 p30 -95.99 -17.37 21.05 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 171.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.875 ' HB3' ' HA ' ' A' ' 998' ' ' LEU . 37.2 tptt -65.86 -40.77 91.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 121.152 0.501 . . . . 0.0 109.906 168.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.964 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.0 ptt? -78.29 -34.42 48.82 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 177.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.869 ' O ' ' HB2' ' A' 1007 ' ' GLN . 27.1 tttp -61.42 -56.81 16.1 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.044 176.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' 1004 ' ' LEU . 14.0 mt -66.4 -48.32 70.48 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.757 -1.11 . . . . 0.0 112.884 -172.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.41 ' HB1' ' HD2' ' A' ' 951' ' ' TYR . . . -60.77 -47.91 84.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.41 0.624 . . . . 0.0 110.481 -178.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.44 59.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.528 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.869 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.9 tp-100 -80.78 -43.14 20.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.3 0.571 . . . . 0.0 110.062 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.639 ' HD2' ' CD2' ' A' 1017 ' ' TYR . 14.5 m-85 -106.18 24.07 13.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.375 -178.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.48 ' HA ' ' HG3' ' A' 1014 ' ' GLN . 3.3 p -52.95 85.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 CA-C-O 121.995 0.903 . . . . 0.0 110.829 173.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.591 ' H ' ' HB2' ' A' 1014 ' ' GLN . 16.2 tpt -152.68 105.97 3.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.48 -177.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 40.0 p 39.54 -110.1 0.09 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 124.426 1.079 . . . . 0.0 113.884 172.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 6.1 m -92.7 -22.22 19.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.511 -172.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 6.7 mp -71.81 -29.8 64.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.052 0.454 . . . . 0.0 110.116 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.709 HE22 ' HB2' ' A' 1018 ' ' LYS . 0.7 OUTLIER -57.99 -48.89 78.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.221 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.577 ' N ' HE21 ' A' 1015 ' ' GLN . 0.0 OUTLIER -53.78 -34.71 59.94 Favored 'General case' 0 C--O 1.223 -0.3 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -172.138 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' 1017 ' ' TYR . 0.4 OUTLIER -49.49 -59.56 3.64 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.52 1.152 . . . . 0.0 110.236 171.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.639 ' CD2' ' HD2' ' A' 1008 ' ' TYR . 86.8 m-85 -69.04 -29.95 68.21 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.031 -1.895 . . . . 0.0 110.928 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.709 ' HB2' HE22 ' A' 1014 ' ' GLN . 81.4 tttt -58.15 -46.91 84.86 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.253 165.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -76.72 -59.59 2.71 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.046 0.451 . . . . 0.0 112.058 -172.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -57.81 -46.31 84.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.19 -176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.705 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 20.4 mmt -74.73 -17.66 60.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.344 -177.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' 1018 ' ' LYS . 34.6 tp -70.92 -30.87 67.32 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 22.4 m -65.39 -38.66 90.67 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.664 173.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -67.35 -36.62 81.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.351 174.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.758 ' HA ' HD11 ' A' ' 998' ' ' LEU . . . -63.9 -34.84 78.85 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.869 177.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.459 ' O ' HG23 ' A' 1030 ' ' VAL . 40.2 t-80 -68.47 -31.32 70.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.719 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -61.28 -54.49 43.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 998' ' ' LEU . 0.3 OUTLIER -56.21 -48.35 76.6 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.049 179.526 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.53 ' N ' HD23 ' A' 1028 ' ' LEU . . . -54.2 -33.11 57.44 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 176.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.466 ' O ' ' HB3' ' A' 1033 ' ' LYS . 85.1 t -84.13 -38.61 14.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.994 0.426 . . . . 0.0 111.027 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.536 ' OD1' HD21 ' A' ' 990' ' ' LEU . 66.2 m-20 -72.7 -29.32 63.28 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.983 178.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.512 ' HB2' HD13 ' A' ' 932' ' ' LEU . . . -52.62 -55.2 24.07 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 161.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.653 ' O ' ' HB3' ' A' 1036 ' ' LEU . 5.0 tmmm? -52.31 -29.45 23.45 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 172.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' 1038 ' ' VAL . 60.5 t30 -68.13 -48.32 65.72 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 121.41 -0.806 . . . . 0.0 109.193 177.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.812 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 10.3 tp -64.18 -32.49 74.08 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.88 174.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.964 ' HA ' HG11 ' A' ' 929' ' ' VAL . 3.0 tm? -48.65 -32.15 7.82 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.88 0.872 . . . . 0.0 109.781 173.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.603 ' O ' ' HG3' ' A' 1041 ' ' GLN . 22.3 t70 -92.74 -35.96 13.17 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.821 178.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.04 HG13 ' HB3' ' A' ' 983' ' ' GLU . 38.1 t -55.92 -62.21 0.9 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.215 177.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 1.04 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -75.94 -33.33 25.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.923 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.843 ' H ' HD12 ' A' 1039 ' ' ILE . 26.5 t70 -54.76 -31.37 58.55 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.47 162.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.821 ' HB3' ' HE2' ' A' 1045 ' ' LYS . 50.5 mt-30 -77.5 -33.76 54.32 Favored 'General case' 0 C--O 1.206 -1.232 0 C-N-CA 118.964 -1.094 . . . . 0.0 108.25 171.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.634 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.86 -53.07 60.08 Favored 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.571 0.544 . . . . 0.0 110.679 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.93 ' HG2' ' HB3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -46.76 -42.79 17.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.404 172.072 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.486 ' N ' ' HD3' ' A' 1043 ' ' ARG . 60.3 tp -79.4 -28.94 41.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.644 0.259 . . . . 0.0 111.398 177.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.821 ' HE2' ' HB3' ' A' 1041 ' ' GLN . 73.0 mmtt -60.31 -43.85 95.97 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.859 0.838 . . . . 0.0 109.267 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.617 ' HG2' ' HD2' ' A' 1052 ' ' PRO . 18.8 ttt -62.99 -36.33 83.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.347 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.875 HD11 ' HB2' ' A' ' 920' ' ' ARG . 39.3 mm -62.15 -49.96 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.509 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 39.1 t -52.35 -40.05 61.48 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.631 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.412 ' HB2' ' HB1' ' A' ' 978' ' ' ALA . 48.7 tp60 -62.76 -67.89 0.38 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.286 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.7 m -160.36 5.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.45 ' HD3' HD12 ' A' 1047 ' ' ILE . 8.7 tpt180 52.82 71.72 1.37 Allowed Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 109.933 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.617 ' HD2' ' HG2' ' A' 1046 ' ' MET . 4.8 Cg_exo -82.02 41.84 1.2 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 123.561 2.841 . . . . 0.0 112.403 -178.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 10.9 t60 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.417 -0.802 . . . . 0.0 109.433 179.487 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.582 ' HB2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.421 0.629 . . . . 0.0 111.373 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 16.8 p -112.25 19.35 17.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.097 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.45 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.44 53.97 11.98 Favored 'General case' 0 CA--C 1.496 -1.108 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.505 -174.227 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.62 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 29.8 t70 -47.33 -175.31 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 O-C-N 125.834 1.959 . . . . 0.0 112.268 -173.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.467 ' H ' ' CG ' ' A' ' 923' ' ' ASP . 3.6 tmtp? -35.51 -24.09 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 124.294 1.038 . . . . 0.0 112.024 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.821 ' HA ' ' CG2' ' A' ' 968' ' ' THR . 4.1 m -59.23 -52.41 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.297 175.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -76.96 -21.27 55.01 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 122.122 0.963 . . . . 0.0 108.975 -177.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 35.7 mt-10 -79.31 -54.59 5.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.087 -174.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.425 ' OD1' ' HE2' ' A' ' 924' ' ' LYS . 0.2 OUTLIER -71.63 -32.54 68.08 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.812 -177.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 1.003 HG11 ' HA ' ' A' 1036 ' ' LEU . 9.8 p -63.71 -38.34 82.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.476 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.547 ' CG2' HD12 ' A' 1036 ' ' LEU . 7.7 p -70.17 -28.3 65.21 Favored 'General case' 0 CA--C 1.519 -0.225 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.4 -30.59 65.01 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.098 -0.955 . . . . 0.0 112.335 171.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.997 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.2 tt -68.08 -48.73 64.74 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.6 ' O ' HG12 ' A' ' 937' ' ' ILE . 36.0 t -57.51 -44.63 85.25 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.328 0 CA-C-O 121.257 0.551 . . . . 0.0 110.343 174.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.474 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 0.0 OUTLIER -59.04 -32.18 69.52 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.043 176.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -79.7 -26.63 40.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.583 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.632 ' O ' ' HB3' ' A' ' 939' ' ' MET . 14.7 p -83.49 -12.56 11.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 119.719 -0.792 . . . . 0.0 109.035 171.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.6 HG12 ' O ' ' A' ' 933' ' ' VAL . 46.0 mm -73.83 -39.07 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 164.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.617 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 5.6 mm-40 -52.57 -33.8 47.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.314 169.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.97 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 32.5 ttm -60.03 -45.82 91.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.974 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.569 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 48.8 m -68.25 -30.05 69.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.173 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.697 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.6 m -76.49 -33.8 58.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.824 0.821 . . . . 0.0 109.008 -177.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.621 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 19.5 mmtt -60.09 -50.47 73.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.195 -1.366 . . . . 0.0 112.28 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.401 HD13 ' CE1' ' A' ' 951' ' ' TYR . 6.8 tp -69.67 -23.69 26.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.049 -176.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.733 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 78.9 mt-30 -52.68 -61.73 4.28 Favored Pre-proline 0 CA--C 1.54 0.594 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 178.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.733 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 73.6 Cg_endo -99.62 10.0 0.72 Allowed 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.783 1.656 . . . . 0.0 115.148 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.629 ' HB3' ' HG2' ' A' ' 950' ' ' GLU . . . -139.24 159.67 65.34 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 118.885 0.766 . . . . 0.0 112.844 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.7 ' O ' ' HG3' ' A' ' 950' ' ' GLU . 1.5 Cg_endo -83.5 173.92 9.25 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.859 3.039 . . . . 0.0 111.569 174.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 91.4 Cg_exo -48.4 -16.29 0.66 Allowed 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 124.264 3.309 . . . . 0.0 115.277 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -54.43 -18.5 4.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.21 169.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.7 ' HG3' ' O ' ' A' ' 947' ' ' PRO . 0.0 OUTLIER -95.4 -15.42 23.04 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.655 175.189 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 948' ' ' PRO . 5.8 m-30 -49.38 -44.14 44.69 Favored 'General case' 0 CA--C 1.504 -0.82 0 CA-C-O 121.566 0.698 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.125 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.1 OUTLIER -69.84 -56.66 7.31 Favored Pre-proline 0 CA--C 1.555 1.169 0 CA-C-N 114.92 -1.036 . . . . 0.0 112.134 177.617 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.974 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.5 Cg_exo -55.71 -35.08 92.61 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.509 2.139 . . . . 0.0 114.964 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.97 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 24.6 ptt? -65.41 -42.18 92.83 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.798 -0.563 . . . . 0.0 110.091 -177.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.676 HG13 ' HG ' ' A' ' 998' ' ' LEU . 74.7 t -67.41 -28.6 42.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.996 170.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.5 tmpt? -60.29 -40.15 89.44 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 175.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 33.5 mm-40 -54.37 -45.97 72.93 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.423 174.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 961' ' ' ALA . 1.8 t -75.73 -29.6 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.19 -44.09 77.5 Favored Glycine 0 N--CA 1.455 -0.09 0 C-N-CA 119.81 -1.186 . . . . 0.0 111.829 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.478 HD22 ' HE3' ' A' ' 956' ' ' LYS . 11.0 mp -64.52 -21.29 66.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.089 0.471 . . . . 0.0 110.574 171.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.2 -53.05 59.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.565 177.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.698 ' HB3' HD22 ' A' ' 995' ' ' LEU . 2.7 tm? -72.51 -28.8 63.1 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.121 177.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.411 ' HB2' ' HA ' ' A' ' 960' ' ' LEU . 60.0 mtp180 -54.69 -59.59 4.51 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 121.756 -0.59 . . . . 0.0 111.717 170.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 17.2 p -55.87 -37.73 69.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.235 0.54 . . . . 0.0 110.559 175.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.772 HD21 HD23 ' A' 1035 ' ' LEU . 23.8 tp -65.85 -27.88 68.56 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.994 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 49.3 tp -64.71 -34.45 78.34 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.65 90.71 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.576 0.703 . . . . 0.0 109.714 173.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.821 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 4.1 m -66.97 -39.68 87.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.04 173.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.654 ' O ' ' HG ' ' A' ' 973' ' ' LEU . 70.8 t -54.62 -37.24 38.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.497 174.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.472 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 35.0 t70 -71.8 -22.77 61.52 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 111.66 0.245 . . . . 0.0 111.66 179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 20.3 mm-40 -65.74 -52.93 47.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 123.187 1.47 . . . . 0.0 108.06 168.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.559 ' OG ' HG21 ' A' ' 980' ' ' THR . 42.3 t -66.06 -25.43 67.03 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 113.291 -1.777 . . . . 0.0 111.855 -178.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 969' ' ' VAL . 53.7 mt -61.35 -51.01 80.88 Favored Pre-proline 0 C--O 1.214 -0.798 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.921 -177.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.564 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 57.2 Cg_exo -56.64 -30.05 82.01 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 121.567 1.595 . . . . 0.0 111.075 168.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.54 HG11 ' O ' ' A' 1042 ' ' ALA . 3.2 t -75.6 -13.36 15.05 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.827 176.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.668 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 4.9 tt -64.35 -55.47 30.36 Favored Pre-proline 0 CA--C 1.535 0.404 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.126 175.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.564 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 51.9 Cg_exo -56.72 -32.26 90.52 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.61 1.54 . . . . 0.0 111.37 174.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -63.18 -65.05 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.012 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 14.1 m -157.99 -36.76 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.793 HG22 ' HB ' ' A' ' 984' ' ' ILE . 4.9 m -55.43 -18.48 7.04 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -174.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.668 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 16.1 p-80 -48.78 -20.19 0.45 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -176.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 79.7 mtt180 -78.11 -55.39 5.32 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 122.077 0.942 . . . . 0.0 110.154 175.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.853 ' HG2' ' HA ' ' A' 1038 ' ' VAL . 0.3 OUTLIER -77.71 -45.77 23.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.287 -0.869 . . . . 0.0 112.389 -175.023 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.793 ' HB ' HG22 ' A' ' 980' ' ' THR . 8.7 tp -56.78 -34.05 42.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.469 -172.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 0.0 OUTLIER -74.45 -34.5 63.19 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.165 179.279 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 16.0 ptp -60.75 -56.4 21.69 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 119.958 -0.697 . . . . 0.0 112.294 -174.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.575 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.62 -33.71 41.23 Favored 'General case' 0 C--O 1.209 -1.042 0 O-C-N 122.262 -0.274 . . . . 0.0 110.973 -176.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 1.092 ' HA ' HD12 ' A' ' 991' ' ' LEU . 7.6 tt0 -61.12 -46.09 92.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.099 0.475 . . . . 0.0 110.889 -176.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' A' ' 989' ' ' LYS . 9.2 mmmm -62.6 -31.48 72.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.71 175.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.688 ' HG ' ' OD1' ' A' 1031 ' ' ASP . 5.7 tp -75.19 -32.9 61.35 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.653 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.092 HD12 ' HA ' ' A' ' 988' ' ' GLN . 8.2 mt -63.58 -48.44 77.39 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.199 0.523 . . . . 0.0 110.053 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -58.06 -38.27 75.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.451 178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.498 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 4.6 t -60.75 -49.86 75.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.059 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -107.02 -27.82 10.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.678 -0.809 . . . . 0.0 113.103 -165.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.924 ' HA ' HD22 ' A' 1028 ' ' LEU . 5.7 tp -56.86 -48.03 79.06 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 167.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.412 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -58.09 -46.66 85.12 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.513 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.692 ' O ' ' HG2' ' A' 1001 ' ' LYS . 10.3 mm-40 -62.81 -36.65 83.87 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.241 178.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.676 ' HG ' HG13 ' A' ' 955' ' ' VAL . 47.0 tp -66.82 -33.4 75.53 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 995' ' ' LEU . 75.9 mt -61.53 -35.97 70.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.897 175.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.664 ' O ' ' HB2' ' A' 1004 ' ' LEU . 49.1 m-80 -89.22 -6.61 56.73 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.526 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 67.1 mmtt -86.58 -36.33 18.94 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 174.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.125 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 0.0 OUTLIER -70.87 -38.12 73.09 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 172.458 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.799 ' O ' ' HB2' ' A' 1007 ' ' GLN . 57.0 tttm -60.37 -54.24 47.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.224 -1.353 . . . . 0.0 108.889 172.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.741 ' HG ' ' CD2' ' A' 1017 ' ' TYR . 14.9 tp -57.89 -48.22 80.49 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -60.69 -46.53 90.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.336 0.589 . . . . 0.0 110.426 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.523 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pt20 -76.34 -12.12 60.01 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.565 0.697 . . . . 0.0 109.8 178.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.799 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.6 tp-100 -81.67 -28.08 33.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.07 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 56.6 t80 -117.51 11.96 13.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.63 -179.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.609 ' HA ' ' HG2' ' A' 1014 ' ' GLN . 8.2 p -47.36 106.71 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.469 -175.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.468 ' HG2' HD12 ' A' 1013 ' ' LEU . 53.0 tpp -153.2 129.65 10.64 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.046 176.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 7.3 t -48.19 128.84 14.7 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.316 0.385 . . . . 0.0 111.441 -178.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 14.8 m 76.3 -46.53 0.53 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.052 176.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.468 HD12 ' HG2' ' A' 1010 ' ' MET . 93.9 mt -72.83 -26.05 61.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.709 0.29 . . . . 0.0 111.211 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.609 ' HG2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.92 -32.53 61.27 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.682 -179.421 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.756 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.8 tt0 -56.13 -31.03 62.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.556 -171.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -51.35 -57.34 9.17 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.214 0.531 . . . . 0.0 110.531 171.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.741 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 4.0 m-30 -73.81 -23.52 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.703 178.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.756 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 62.2 tttp -64.43 -44.65 90.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.24 178.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' 1015 ' ' GLN . 97.3 mttt -59.53 -56.58 20.22 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.987 0.422 . . . . 0.0 109.946 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -50.89 -40.33 56.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.531 174.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.688 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 19.6 ttt -62.43 -52.21 64.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.969 178.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.4 tp -61.93 -35.24 77.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 -179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 40.1 m -63.76 -34.34 77.68 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.156 0.503 . . . . 0.0 110.811 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.687 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -79.7 -39.07 32.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.337 178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -59.75 -43.85 94.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.144 176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.441 ' O ' HG23 ' A' 1030 ' ' VAL . 56.6 t60 -59.48 -36.24 75.64 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.379 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -71.82 -43.4 65.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.401 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.924 HD22 ' HA ' ' A' ' 995' ' ' LEU . 5.0 tp -73.11 -32.0 64.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 178.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.95 -49.87 75.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.17 173.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' 1026 ' ' HIS . 99.2 t -69.17 -19.95 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-O 121.664 0.745 . . . . 0.0 110.622 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.811 ' OD2' ' HA ' ' A' ' 991' ' ' LEU . 0.6 OUTLIER -76.65 -43.79 36.67 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.031 177.25 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.626 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -57.13 -42.15 80.4 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 169.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -63.93 -33.94 76.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.975 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' 1038 ' ' VAL . 65.6 t30 -67.38 -43.69 80.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.898 HD22 HD11 ' A' ' 991' ' ' LEU . 16.3 tp -75.7 -24.39 56.24 Favored 'General case' 0 C--O 1.222 -0.344 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 1.003 ' HA ' HG11 ' A' ' 929' ' ' VAL . 0.0 OUTLIER -63.2 -32.67 74.12 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 120.876 0.369 . . . . 0.0 110.427 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.576 ' N ' HD23 ' A' 1036 ' ' LEU . 32.2 t70 -86.7 -36.9 18.44 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 175.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.853 ' HA ' ' HG2' ' A' ' 983' ' ' GLU . 25.4 t -52.82 -63.15 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.354 176.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.891 HD11 ' HB ' ' A' ' 929' ' ' VAL . 4.4 pt -81.54 -28.63 10.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.188 -174.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 3.5 t70 -51.7 -48.41 63.55 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 163.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' 1045 ' ' LYS . 41.8 mt-30 -71.75 -25.94 62.25 Favored 'General case' 0 C--O 1.203 -1.35 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.224 177.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.628 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.7 -54.68 30.18 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 118.177 0.444 . . . . 0.0 110.969 175.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.62 ' HE ' ' HB3' ' A' ' 923' ' ' ASP . 2.0 mpt_? -55.35 -32.96 62.98 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.138 174.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.506 ' HB2' ' HD2' ' A' ' 920' ' ' ARG . 55.2 tp -72.61 -37.05 68.21 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.784 -0.189 . . . . 0.0 110.874 174.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 68.5 mmtt -58.88 -33.44 70.49 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 175.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.461 ' O ' ' HB3' ' A' 1050 ' ' SER . 27.1 ttt -73.07 -37.16 66.91 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.396 -1.275 . . . . 0.0 109.576 -178.063 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' 1043 ' ' ARG . 51.4 mm -61.16 -45.77 97.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 171.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 13.2 t -56.47 -60.25 3.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.243 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -87.47 -55.52 3.76 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -174.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' 1046 ' ' MET . 21.4 t -66.85 -44.3 81.38 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.946 -173.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 63.05 106.64 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-O 121.394 0.616 . . . . 0.0 111.382 179.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -82.18 35.36 0.58 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.258 2.639 . . . . 0.0 113.517 -173.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 47.3 t60 . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.462 -0.78 . . . . 0.0 109.923 -179.485 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.635 ' HG2' ' H ' ' A' ' 922' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 36.0 m -86.91 26.45 1.14 Allowed 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.997 178.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.635 ' H ' ' HG2' ' A' ' 920' ' ' ARG . 0.1 OUTLIER 45.6 62.17 2.3 Favored 'General case' 0 CA--C 1.499 -1.004 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.11 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.649 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 6.5 t0 -46.01 -176.17 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 O-C-N 125.733 1.895 . . . . 0.0 112.702 -173.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 924' ' ' LYS . 1.8 tmtp? -36.59 -24.82 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 124.236 1.014 . . . . 0.0 111.914 177.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.883 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.1 m -58.63 -52.3 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.104 175.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 922' ' ' ASN . 64.1 t80 -75.92 -24.66 55.56 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -176.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 31.1 mt-10 -70.51 -55.9 7.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.544 -178.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.537 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 0.2 OUTLIER -73.77 -32.89 64.01 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.468 -176.586 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.961 HG11 ' HA ' ' A' 1036 ' ' LEU . 5.5 p -62.84 -35.83 72.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.294 176.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.669 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 6.5 p -72.43 -32.71 66.54 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.79 -31.28 67.47 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.35 172.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.649 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 2.8 tp -62.0 -46.79 87.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.551 ' O ' HG22 ' A' ' 936' ' ' VAL . 61.3 t -62.8 -37.78 80.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.907 0.384 . . . . 0.0 110.442 174.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.669 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.4 mmpt? -62.47 -31.97 72.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.388 0.613 . . . . 0.0 109.784 176.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.688 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -81.61 -24.6 36.31 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.561 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.744 ' O ' ' HG2' ' A' ' 939' ' ' MET . 1.6 m -79.61 -10.76 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 C-N-CA 119.211 -0.996 . . . . 0.0 109.358 172.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.531 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 67.0 mt -73.86 -30.54 28.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 167.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.6 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 7.5 mm-40 -55.21 -47.42 75.32 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.001 170.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.744 ' HG2' ' O ' ' A' ' 936' ' ' VAL . 11.5 ptt? -62.19 -40.6 96.6 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.283 0.364 . . . . 0.0 110.604 -175.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 3.5 p -68.9 -31.55 70.54 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.568 0.223 . . . . 0.0 111.27 -178.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.713 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 15.8 m -80.08 -42.75 23.05 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.643 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 3.5 tppp? -59.67 -39.34 84.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 113.268 -1.787 . . . . 0.0 111.479 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.785 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 0.0 OUTLIER -73.64 -31.98 33.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 121.321 -0.152 . . . . 0.0 110.975 -179.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.1 mt-30 -49.91 -61.84 3.2 Favored Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.713 ' HD3' ' O ' ' A' ' 941' ' ' SER . 93.7 Cg_endo -99.12 16.1 0.49 Allowed 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.09 1.86 . . . . 0.0 113.42 -172.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.952 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -116.39 151.84 47.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 5.4 Cg_exo -80.91 -179.63 5.26 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 123.766 2.978 . . . . 0.0 110.516 170.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.555 ' O ' ' HB2' ' A' ' 951' ' ' TYR . 10.2 Cg_endo -53.41 -24.88 29.45 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.804 2.336 . . . . 0.0 113.063 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.461 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 36.3 mt-10 -57.17 -44.11 83.22 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.718 178.113 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.952 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 1.9 mp0 -94.03 1.09 56.27 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.569 177.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.628 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.6 m-85 -58.12 -45.56 87.07 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 170.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.089 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.8 OUTLIER -72.33 -47.01 10.54 Favored Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 119.502 -0.879 . . . . 0.0 112.293 176.127 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.089 ' HD3' HG13 ' A' ' 952' ' ' VAL . 80.4 Cg_exo -51.47 -30.78 36.41 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 122.093 1.862 . . . . 0.0 115.108 171.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.785 ' SD ' ' HB ' ' A' ' 943' ' ' ILE . 2.4 ptt? -64.62 -46.02 84.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.95 -1.1 . . . . 0.0 108.653 177.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.673 ' N ' ' HG3' ' A' ' 954' ' ' MET . 0.3 OUTLIER -64.33 -25.06 37.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.777 173.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.4 ttmm -61.85 -37.59 85.06 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 176.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -59.35 -46.73 87.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.863 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.644 HG12 ' HA ' ' A' ' 936' ' ' VAL . 9.0 m -65.5 -28.16 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.605 176.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.89 -43.82 64.47 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.179 -1.01 . . . . 0.0 111.921 178.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.38 -36.63 71.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.95 0.405 . . . . 0.0 110.24 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.688 ' HB2' ' HB3' ' A' ' 935' ' ' ALA . . . -56.9 -56.04 26.73 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.792 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.532 ' CB ' ' HG ' ' A' ' 995' ' ' LEU . 30.6 tp -63.08 -35.5 80.47 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.649 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 966' ' ' LEU . 52.1 mtm-85 -62.73 -48.95 77.02 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.272 176.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.508 HG22 ' OD1' ' A' ' 928' ' ' ASN . 5.5 m -56.08 -39.05 71.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.773 0.797 . . . . 0.0 109.792 172.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.592 HD22 HD22 ' A' ' 932' ' ' LEU . 64.8 tp -62.48 -27.66 69.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.974 176.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 86.1 mt -64.77 -28.94 69.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.331 178.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -63.84 -40.93 97.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.249 0.547 . . . . 0.0 109.713 172.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.755 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.5 m -61.46 -43.74 98.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.57 172.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.554 HG13 HD11 ' A' ' 984' ' ' ILE . 91.2 t -54.88 -31.42 24.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.157 177.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.481 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.9 t70 -75.78 -26.3 57.21 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.571 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 57.1 mm-40 -70.66 -49.15 50.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 122.709 1.242 . . . . 0.0 108.92 171.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.626 ' OG ' HG21 ' A' ' 980' ' ' THR . 43.3 t -68.28 -24.69 64.9 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.67 -1.604 . . . . 0.0 111.649 -179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.71 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 3.8 tt -61.43 -51.45 77.38 Favored Pre-proline 0 C--O 1.218 -0.591 0 CA-C-O 118.787 -0.625 . . . . 0.0 111.614 -177.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 49.4 Cg_exo -59.82 -27.35 84.73 Favored 'Trans proline' 0 C--N 1.353 0.771 0 CA-C-N 121.09 1.425 . . . . 0.0 111.214 170.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.7 t -78.24 -11.8 13.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.318 175.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.864 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.8 tt -65.64 -54.86 26.98 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.801 -0.619 . . . . 0.0 111.207 176.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.572 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 28.3 Cg_endo -64.84 -23.53 62.28 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.302 1.334 . . . . 0.0 111.186 174.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.94 -60.38 3.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.375 172.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.836 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.3 m -165.35 -34.43 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -177.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.827 HG22 ' HB ' ' A' ' 984' ' ' ILE . 22.0 m -55.83 -19.91 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 -172.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.864 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 11.7 p-80 -49.74 -21.15 0.99 Allowed 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.891 0.701 . . . . 0.0 112.891 -173.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -73.98 -52.96 11.14 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.672 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.035 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.75 -43.38 30.99 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.202 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.827 ' HB ' HG22 ' A' ' 980' ' ' THR . 0.0 OUTLIER -58.27 -34.75 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -173.316 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -73.81 -32.4 63.72 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.657 175.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.511 ' HE1' ' HG3' ' A' ' 983' ' ' GLU . 12.0 ptt? -69.14 -54.44 14.89 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.564 -175.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.679 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.08 -33.92 38.45 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -175.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 991' ' ' LEU . 53.3 tp60 -59.37 -46.42 88.69 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.258 0.481 . . . . 0.0 111.049 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -67.76 -25.69 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.505 0.669 . . . . 0.0 109.965 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 1.7 tp -73.25 -42.33 62.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.305 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.992 HD12 ' HA ' ' A' ' 988' ' ' GLN . 10.3 mt -58.57 -49.15 78.48 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-O 121.365 0.602 . . . . 0.0 109.897 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.452 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 10.2 t30 -55.73 -41.08 73.35 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.545 -177.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.6 t -69.48 -43.09 73.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.61 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 997' ' ' GLU . 35.7 m-20 -95.63 -41.0 9.12 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.195 -0.602 . . . . 0.0 112.383 -169.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.042 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -59.38 -53.13 61.7 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 175.317 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 992' ' ' ASN . . . -60.6 -48.58 81.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.439 -177.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' 1001 ' ' LYS . 10.0 pt-20 -64.34 -32.02 73.45 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 118.949 -1.1 . . . . 0.0 111.414 -178.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.725 HD23 HD13 ' A' 1028 ' ' LEU . 54.9 tp -64.48 -38.27 90.43 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.663 -0.815 . . . . 0.0 109.852 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.549 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 76.8 mt -55.59 -39.22 53.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.401 176.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.694 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 33.8 m-80 -95.49 -5.27 43.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.004 -178.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 997' ' ' GLU . 15.8 tptp -83.35 -44.39 14.91 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.477 ' SD ' ' HB3' ' A' ' 951' ' ' TYR . 40.0 tpp -78.51 -31.14 47.53 Favored 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.947 173.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.761 ' O ' ' HB2' ' A' 1007 ' ' GLN . 83.3 tttt -58.34 -49.21 77.99 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 171.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . . . . . . . . . 14.0 mt -61.33 -37.29 82.73 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 173.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.43 ' HA ' ' HB3' ' A' 1017 ' ' TYR . . . -67.63 -44.8 77.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.381 0.61 . . . . 0.0 110.69 178.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.49 HE21 ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -74.26 -9.72 58.89 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.229 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.761 ' HB2' ' O ' ' A' 1003 ' ' LYS . 0.7 OUTLIER -91.53 -10.5 40.48 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.124 -0.943 . . . . 0.0 109.718 175.646 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 26.1 t80 -123.82 12.19 9.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.271 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.577 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 7.1 p -58.76 95.47 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.989 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 25.4 mmt -121.6 3.77 10.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.402 175.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.425 ' H ' ' HB2' ' A' 1014 ' ' GLN . 60.1 m 68.28 131.27 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.426 -173.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 23.1 t 71.29 -60.61 0.51 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.048 0.539 . . . . 0.0 109.919 -174.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.7 -28.18 68.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.291 0.567 . . . . 0.0 109.578 174.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.596 ' NE2' ' HB2' ' A' 1018 ' ' LYS . 1.1 tm0? -60.77 -38.65 85.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.884 177.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.562 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 46.5 mt-30 -67.42 -30.68 70.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.779 -175.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.58 -47.44 57.95 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.675 169.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.43 ' HB3' ' HA ' ' A' 1005 ' ' ALA . 2.6 m-30 -77.42 -24.71 50.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.776 178.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.596 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 83.9 tttt -72.44 -37.21 68.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.754 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -66.77 -50.81 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 175.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -46.86 -40.99 14.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.271 170.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.466 ' HB3' ' O ' ' A' 1018 ' ' LYS . 14.3 tmm? -61.46 -43.15 99.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.443 177.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 96.2 mt -57.6 -42.0 82.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.755 0.312 . . . . 0.0 111.089 178.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 12.5 m -63.36 -36.4 83.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.064 0.459 . . . . 0.0 110.551 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.25 -36.23 47.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.814 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.638 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.1 -31.87 73.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.628 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 61.4 t60 -72.1 -46.38 56.96 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.109 176.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.92 -37.79 85.97 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.088 0.471 . . . . 0.0 109.981 177.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.042 HD12 ' HA ' ' A' ' 995' ' ' LEU . 2.0 tt -58.74 -51.77 68.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.557 172.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.68 -34.82 65.38 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.712 176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 84.5 t -66.4 -33.81 65.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 174.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.671 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 2.1 p30 -71.89 -41.92 67.39 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -55.81 -50.37 70.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.623 0.725 . . . . 0.0 110.025 171.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.556 ' O ' ' HB3' ' A' 1036 ' ' LEU . 13.3 tptm -66.5 -37.17 84.49 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.921 -1.036 . . . . 0.0 112.005 -174.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.571 ' O ' HG23 ' A' 1038 ' ' VAL . 60.4 t30 -75.71 -35.11 60.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.412 -174.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.761 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 7.0 tp -77.67 -30.04 51.8 Favored 'General case' 0 C--O 1.213 -0.829 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.961 ' HA ' HG11 ' A' ' 929' ' ' VAL . 6.4 tt -48.77 -41.67 33.16 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.698 0.761 . . . . 0.0 109.538 172.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -75.71 -46.74 29.47 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 114.186 -1.37 . . . . 0.0 109.205 174.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.035 HG13 ' HB3' ' A' ' 983' ' ' GLU . 17.7 t -48.02 -58.91 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.883 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.6 pp -83.44 -30.46 8.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -173.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.737 ' H ' HD12 ' A' 1039 ' ' ILE . 5.5 t0 -56.94 -42.48 80.14 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 165.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' A' 1045 ' ' LYS . 55.0 mt-30 -75.12 -23.62 57.93 Favored 'General case' 0 C--O 1.198 -1.616 0 CA-C-N 114.332 -1.304 . . . . 0.0 110.837 174.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.64 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.38 -55.36 29.4 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 118.818 0.735 . . . . 0.0 110.721 171.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.649 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 0.9 OUTLIER -58.66 -27.67 64.98 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.703 173.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.557 ' O ' HD23 ' A' 1044 ' ' LEU . 5.8 tt -75.35 -32.87 61.0 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.018 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.836 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 74.1 mmtt -61.39 -30.28 70.45 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 175.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.413 ' HG2' ' HG3' ' A' 1052 ' ' PRO . 24.5 ttt -77.23 -30.26 54.48 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.931 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.593 ' HA ' ' HA ' ' A' 1051 ' ' ARG . 48.5 mm -65.36 -46.55 90.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 169.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 52.4 m -55.67 -37.54 68.43 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.972 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -60.03 -71.15 0.14 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.341 175.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.63 ' O ' ' HG2' ' A' 1051 ' ' ARG . 18.7 m -153.66 -2.24 0.21 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.913 177.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.63 ' HG2' ' O ' ' A' 1050 ' ' SER . 5.4 ptp180 61.18 124.46 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 C-N-CA 124.065 0.946 . . . . 0.0 110.969 -170.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 12.6 Cg_exo -68.8 148.25 70.75 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.964 2.443 . . . . 0.0 112.717 -174.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.245 0.835 0 CA-C-O 118.57 -0.729 . . . . 0.0 109.048 174.717 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 1.055 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 21.1 t -97.78 25.55 5.81 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.175 0.512 . . . . 0.0 109.728 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER 50.11 62.33 2.72 Favored 'General case' 0 CA--C 1.498 -1.045 0 CA-C-O 122.129 0.966 . . . . 0.0 109.479 -176.399 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.512 ' O ' ' N ' ' A' ' 925' ' ' VAL . 29.4 m-20 -44.62 -171.6 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 110.77 -2.923 . . . . 0.0 113.547 -176.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.502 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 1.2 tmtm? -38.09 -17.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.883 0.873 . . . . 0.0 112.865 -178.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 1.03 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 15.8 m -65.05 -52.97 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 O-C-N 122.155 -0.341 . . . . 0.0 111.719 177.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.526 ' N ' HG23 ' A' ' 925' ' ' VAL . 46.4 t80 -75.89 -22.3 56.27 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -174.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -74.52 -61.64 1.8 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.209 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.438 ' OD1' HG22 ' A' ' 964' ' ' THR . 0.2 OUTLIER -65.96 -31.79 72.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.806 -173.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.802 HG11 ' HA ' ' A' 1036 ' ' LEU . 11.0 p -65.25 -43.42 95.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.606 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 18.4 p -71.21 -25.17 62.4 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 173.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.77 -27.95 62.39 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.028 170.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.908 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 4.8 tt -65.56 -46.43 79.52 Favored 'General case' 0 CA--C 1.523 -0.065 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 172.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 937' ' ' ILE . 44.1 t -58.71 -41.71 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.644 175.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.7 OUTLIER -65.49 -27.69 68.67 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.061 0.457 . . . . 0.0 110.972 177.596 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.599 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -81.28 -26.17 35.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.198 179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.59 ' HA ' HG12 ' A' ' 958' ' ' VAL . 13.3 p -82.96 -12.49 12.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.638 0.733 . . . . 0.0 109.489 172.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 933' ' ' VAL . 49.4 mm -66.95 -34.6 71.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 165.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 32.8 mt-10 -62.18 -47.53 84.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.063 174.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 42.8 ttp -55.57 -39.74 71.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.19 176.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.627 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 13.3 t -61.93 -38.2 87.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.07 0.462 . . . . 0.0 110.546 178.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.566 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 14.0 m -78.24 -40.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 122.165 0.983 . . . . 0.0 108.597 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.697 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 5.9 tmtp? -67.86 -34.94 77.66 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 113.464 -1.698 . . . . 0.0 111.278 -177.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.561 ' HA ' ' HB3' ' A' ' 946' ' ' ALA . 0.0 OUTLIER -73.4 -28.4 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.281 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.68 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 74.5 mt-30 -49.7 -54.24 33.59 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.624 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 74.6 Cg_endo -99.63 21.43 0.26 Allowed 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.94 1.76 . . . . 0.0 113.37 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.697 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -94.95 130.11 33.79 Favored Pre-proline 0 C--N 1.33 -0.271 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -171.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 92.9 Cg_endo -85.31 -179.31 3.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.034 2.489 . . . . 0.0 108.94 158.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.745 ' HA ' ' CD2' ' A' ' 951' ' ' TYR . 73.5 Cg_exo -51.07 -33.7 44.21 Favored 'Trans proline' 0 C--O 1.241 0.647 0 C-N-CA 122.048 1.832 . . . . 0.0 112.089 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.549 ' HB2' ' HG2' ' A' ' 947' ' ' PRO . 5.0 mp0 -55.07 -42.24 72.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.244 176.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.64 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 29.7 mm-40 -94.86 -5.8 44.19 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.468 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.745 ' CD2' ' HA ' ' A' ' 948' ' ' PRO . 12.1 m-30 -59.82 -37.32 78.84 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.941 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -73.3 -53.47 4.71 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 120.282 -0.567 . . . . 0.0 112.054 176.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.941 ' HD3' HG13 ' A' ' 952' ' ' VAL . 63.6 Cg_exo -56.65 -31.57 87.78 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 122.033 1.822 . . . . 0.0 114.454 175.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.596 ' HG3' ' HG3' ' A' ' 939' ' ' MET . 18.4 ptt? -68.42 -36.71 79.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.232 1.015 . . . . 0.0 109.592 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.969 HG11 ' HA ' ' A' ' 999' ' ' ILE . 84.3 t -71.87 -25.41 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.873 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.868 174.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.567 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 59.4 tttp -56.24 -39.51 72.67 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -55.75 -48.17 75.73 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.032 175.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.59 HG12 ' HA ' ' A' ' 936' ' ' VAL . 3.8 m -76.52 -22.82 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-O 120.944 0.402 . . . . 0.0 112.017 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -70.55 -42.17 64.11 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.675 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 81.5 mt -70.25 -24.57 63.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.91 0.386 . . . . 0.0 110.004 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -57.0 -56.39 22.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.62 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.581 HD11 HD13 ' A' ' 991' ' ' LEU . 53.7 tp -72.4 -31.5 65.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.199 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.461 ' C ' ' HD3' ' A' ' 963' ' ' ARG . 3.3 tmt_? -61.54 -53.67 53.34 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.438 HG22 ' OD1' ' A' ' 928' ' ' ASN . 15.7 m -59.14 -32.34 69.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.301 0.572 . . . . 0.0 110.526 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.835 HD12 HD12 ' A' ' 932' ' ' LEU . 0.5 OUTLIER -63.79 -41.67 97.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.937 177.254 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 962' ' ' LEU . 96.6 mt -53.04 -31.22 40.22 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.317 174.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -49.61 74.73 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.415 0.626 . . . . 0.0 109.795 173.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.844 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 1.2 m -56.2 -46.23 79.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.629 170.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.474 HG13 HD11 ' A' ' 984' ' ' ILE . 90.4 t -53.36 -30.81 17.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.81 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.424 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 13.0 t70 -70.6 -33.1 70.67 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.325 178.37 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.8 mm-40 -60.49 -54.59 43.73 Favored 'General case' 0 C--O 1.247 0.946 0 CA-C-O 122.603 1.192 . . . . 0.0 108.46 171.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 40.0 t -55.61 -26.82 46.12 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 114.224 -1.353 . . . . 0.0 112.129 174.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 1.034 ' HA ' HD13 ' A' ' 976' ' ' LEU . 7.0 tt -57.99 -53.85 61.57 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-O 118.7 -0.666 . . . . 0.0 111.743 -174.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.644 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.8 Cg_exo -54.87 -26.99 51.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 CA-C-N 120.857 1.342 . . . . 0.0 111.25 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.737 HG13 ' HB2' ' A' 1046 ' ' MET . 3.8 t -78.3 -17.32 13.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 120.073 -0.651 . . . . 0.0 111.554 176.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 1.038 ' HG ' HG21 ' A' ' 984' ' ' ILE . 8.6 mp -56.86 -64.37 2.59 Favored Pre-proline 0 N--CA 1.471 0.616 0 CA-C-O 119.121 -0.466 . . . . 0.0 110.36 173.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.724 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 15.2 Cg_endo -57.67 -30.33 88.5 Favored 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 121.625 1.55 . . . . 0.0 111.826 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -58.17 -57.39 13.08 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.355 174.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 1.063 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 59.9 m -163.3 -47.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.118 0.485 . . . . 0.0 111.463 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.726 HG22 ' HB ' ' A' ' 984' ' ' ILE . 23.8 m -48.54 -24.12 1.21 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -171.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.543 ' HA ' ' CG2' ' A' ' 984' ' ' ILE . 49.8 p-80 -50.06 -32.51 15.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -169.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -66.71 -52.86 39.65 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 119.455 1.025 . . . . 0.0 111.968 176.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.744 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.2 OUTLIER -70.71 -45.54 64.76 Favored 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.338 -179.23 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 1.038 HG21 ' HG ' ' A' ' 976' ' ' LEU . 8.8 tp -57.68 -39.38 69.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.609 -175.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 11.7 pt-20 -69.98 -27.28 64.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.014 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.587 ' HG3' ' N ' ' A' ' 987' ' ' ALA . 5.4 ptp -71.97 -46.74 56.26 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.557 -0.857 . . . . 0.0 109.801 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.908 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -72.48 -47.09 51.52 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.847 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.871 ' HA ' HD12 ' A' ' 991' ' ' LEU . 27.2 tt0 -57.59 -45.69 84.95 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -175.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -65.22 -35.08 79.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.441 0.639 . . . . 0.0 109.315 177.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.77 -35.6 78.99 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.682 177.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.871 HD12 ' HA ' ' A' ' 988' ' ' GLN . 15.6 mt -61.3 -57.47 12.2 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.316 0.579 . . . . 0.0 109.671 175.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -45.8 -43.0 12.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.812 -1.086 . . . . 0.0 112.053 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 997' ' ' GLU . 17.1 p -76.26 -46.55 27.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 -178.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.538 ' HB2' ' HB3' ' A' 1031 ' ' ASP . 1.0 OUTLIER -82.65 -37.32 25.05 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -169.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.704 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.9 OUTLIER -58.61 -47.0 85.83 Favored 'General case' 0 C--O 1.226 -0.149 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 168.443 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.826 ' HA ' HG22 ' A' ' 999' ' ' ILE . . . -52.7 -28.38 21.66 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 993' ' ' SER . 77.1 mt-10 -77.13 -34.08 56.67 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 118.575 -1.25 . . . . 0.0 108.693 -179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.666 HD23 HD13 ' A' 1028 ' ' LEU . 18.6 tp -78.23 -29.03 48.02 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.969 ' HA ' HG11 ' A' ' 955' ' ' VAL . 5.8 tt -77.21 -0.74 3.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 CA-C-O 121.908 0.861 . . . . 0.0 108.827 172.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.695 ' HA ' ' HB2' ' A' 1003 ' ' LYS . 6.8 m-80 -102.78 -6.36 22.67 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.62 170.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 1.01 ' HD3' ' HB2' ' A' 1021 ' ' MET . 42.3 tptt -73.12 -36.8 66.78 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.522 -1.659 . . . . 0.0 106.522 162.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.745 ' HB2' ' HB ' ' A' ' 955' ' ' VAL . 24.2 ttm -64.77 -60.96 2.49 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 114.42 -1.264 . . . . 0.0 108.626 171.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.779 ' O ' ' HB2' ' A' 1007 ' ' GLN . 45.3 mttp -65.17 -57.11 9.38 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.241 -174.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.665 HD23 ' HB3' ' A' 1017 ' ' TYR . 8.4 tt -82.3 -31.31 30.06 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -163.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.532 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -71.33 -43.19 67.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.075 178.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.426 HE21 ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -76.79 -26.28 54.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.458 176.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.779 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.9 tp-100 -53.83 -52.96 58.68 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.828 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.629 ' CE2' ' HG ' ' A' 1004 ' ' LEU . 28.1 m-85 -92.18 -53.83 4.08 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.851 -175.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.514 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 11.3 p 40.63 45.51 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-O 122.16 0.981 . . . . 0.0 111.887 -176.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 17.9 mmt -88.77 90.61 8.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.517 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 44.4 p 40.91 -99.77 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 174.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 62.4 p -94.85 -28.18 15.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.892 0.377 . . . . 0.0 111.026 -176.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 7.3 mp -69.58 -13.15 62.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.066 -178.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.736 ' HA ' ' CD2' ' A' 1017 ' ' TYR . 1.0 OUTLIER -57.91 -35.01 70.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.398 175.604 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.415 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 2.6 mp0 -59.88 -22.41 62.31 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -175.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -53.99 -59.54 4.5 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 167.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.736 ' CD2' ' HA ' ' A' 1014 ' ' GLN . 0.3 OUTLIER -61.55 -20.43 63.25 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.725 ' O ' ' HB3' ' A' 1021 ' ' MET . 39.5 ttmt -79.35 -43.46 23.48 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.301 171.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -68.04 -41.88 81.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.397 0.618 . . . . 0.0 109.343 177.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.473 HE21 ' HB2' ' A' 1020 ' ' GLN . 7.0 tt0 -56.23 -31.46 63.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.696 173.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 1.01 ' HB2' ' HD3' ' A' 1001 ' ' LYS . 43.5 ttp -56.49 -44.73 80.93 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.006 173.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 45.3 tp -55.69 -43.05 76.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.595 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 26.1 m -71.38 -46.57 59.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.714 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -55.5 -45.94 76.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.713 178.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -64.26 -36.35 83.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 110.491 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.594 ' O ' HG23 ' A' 1030 ' ' VAL . 14.1 t-80 -66.94 -42.25 85.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.16 177.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -61.53 -47.54 85.09 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.477 0.485 . . . . 0.0 110.906 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.704 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.9 OUTLIER -65.41 -42.26 92.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.588 0.709 . . . . 0.0 110.233 -179.081 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -56.61 -28.95 61.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.907 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' 1026 ' ' HIS . 74.2 t -74.29 -47.69 39.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.122 177.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.704 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -59.74 -42.36 92.99 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.694 179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -62.83 -49.95 72.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.982 0.42 . . . . 0.0 110.436 175.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.731 ' HA ' HD23 ' A' 1036 ' ' LEU . 87.6 tttt -59.81 -38.51 82.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.706 -179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.533 ' O ' HG23 ' A' 1038 ' ' VAL . 9.1 t30 -72.4 -53.72 11.43 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.315 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 991' ' ' LEU . 29.0 tp -56.5 -33.96 66.5 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 119.112 -0.471 . . . . 0.0 112.141 177.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.802 ' HA ' HG11 ' A' ' 929' ' ' VAL . 1.8 pp -61.79 -38.67 88.92 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.809 0.731 . . . . 0.0 109.396 179.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.0 t70 -66.97 -40.07 87.36 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.421 -1.263 . . . . 0.0 109.181 174.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.908 HG21 ' HB2' ' A' ' 987' ' ' ALA . 76.7 t -60.87 -68.44 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.653 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 1.03 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.4 pp -70.07 -33.75 56.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -173.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.74 ' H ' HD12 ' A' 1039 ' ' ILE . 6.9 t70 -48.81 -45.18 40.04 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 122.43 1.109 . . . . 0.0 108.372 166.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' A' 1045 ' ' LYS . 82.1 mm-40 -79.11 -24.84 43.13 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-N 113.487 -1.688 . . . . 0.0 111.134 177.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -54.01 -55.02 31.15 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.526 173.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 1.055 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 21.8 mmm180 -57.86 -32.97 68.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.829 177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.634 HD12 ' HB ' ' A' 1047 ' ' ILE . 60.3 tp -77.99 -26.33 48.55 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 121.113 -0.235 . . . . 0.0 111.235 175.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 1.063 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 46.7 mmtm -57.08 -44.45 83.11 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.664 0.745 . . . . 0.0 109.536 171.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.737 ' HB2' HG13 ' A' ' 975' ' ' VAL . 26.9 ttt -65.62 -38.93 90.81 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.66 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.634 ' HB ' HD12 ' A' 1044 ' ' LEU . 49.7 mm -66.87 -35.81 75.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.894 175.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 36.9 t -60.55 -53.85 52.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.91 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -69.99 -44.2 69.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.046 0.451 . . . . 0.0 110.911 -178.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 46.2 m -94.36 22.87 5.61 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.388 -175.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.71 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 62.3 ttt180 -59.88 -50.73 85.14 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.535 176.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.71 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 11.4 Cg_exo -72.28 -75.29 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 121.601 1.534 . . . . 0.0 110.939 171.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 38.6 p-80 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.562 177.687 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.938 ' HG2' ' HB2' ' A' 1043 ' ' ARG . 20.3 tpt180 . . . . . 0 C--O 1.232 0.166 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 920' ' ' ARG . 67.5 m 71.27 105.37 0.06 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 -160.32 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.687 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -53.53 85.44 0.0 OUTLIER 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -166.884 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 922' ' ' ASN . 1.9 t70 -47.16 -174.7 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 112.785 -2.007 . . . . 0.0 113.238 -174.307 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.9 tmtp? -41.82 -23.15 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.428 -178.534 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.823 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 1.9 m -56.41 -54.86 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 118.745 -0.645 . . . . 0.0 112.048 172.716 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.687 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 20.2 t80 -74.37 -34.91 63.5 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 118.843 -1.143 . . . . 0.0 107.934 -175.133 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.49 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 11.8 mm-40 -58.68 -57.27 13.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 113.113 -1.858 . . . . 0.0 112.877 -176.47 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.463 ' HB3' ' OG1' ' A' ' 968' ' ' THR . 3.1 t-20 -73.72 -35.26 65.08 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.905 -171.554 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.774 HG22 ' CD2' ' A' ' 965' ' ' LEU . 3.8 t -61.69 -36.03 71.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 120.036 -0.666 . . . . 0.0 110.235 175.012 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.568 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 42.5 m -66.5 -37.75 85.74 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 171.942 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.36 -30.37 64.58 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.691 174.3 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.564 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 18.9 tp -61.42 -39.38 90.56 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.344 -0.614 . . . . 0.0 109.344 173.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.617 ' O ' HG13 ' A' ' 937' ' ' ILE . 48.0 t -66.14 -40.73 87.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.607 173.256 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.5 OUTLIER -61.73 -33.69 74.49 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.872 0.368 . . . . 0.0 111.367 178.438 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -80.63 -26.56 37.65 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.33 -179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.567 ' O ' ' HG2' ' A' ' 939' ' ' MET . 9.5 p -78.19 -16.44 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 C-N-CA 119.448 -0.901 . . . . 0.0 108.877 171.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.617 HG13 ' O ' ' A' ' 933' ' ' VAL . 51.4 mt -67.33 -38.13 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 167.112 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.676 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 64.9 mm-40 -52.52 -38.52 59.84 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.123 172.221 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.929 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 1.9 ptt? -61.63 -40.57 95.34 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 t -74.24 -31.05 62.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.378 179.191 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.676 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.1 t -71.57 -52.55 17.57 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.538 0.685 . . . . 0.0 110.095 -176.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.53 ' HD2' ' HB3' ' A' ' 954' ' ' MET . 0.0 OUTLIER -80.18 -11.03 59.78 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.03 -173.602 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.976 ' HA ' ' HG3' ' A' ' 950' ' ' GLU . 0.1 OUTLIER -79.65 -26.97 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 121.748 0.785 . . . . 0.0 109.264 173.772 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 940' ' ' SER . 77.8 mt-30 -60.97 -51.77 76.98 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.83 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.676 ' HD3' ' O ' ' A' ' 941' ' ' SER . 85.5 Cg_endo -97.3 17.57 0.57 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 121.459 1.439 . . . . 0.0 114.992 -176.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -130.65 167.47 21.07 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.411 ' CB ' ' HD2' ' A' ' 948' ' ' PRO . 6.5 Cg_endo -90.52 170.02 3.81 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 124.031 3.154 . . . . 0.0 111.776 168.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.555 ' C ' ' H ' ' A' ' 950' ' ' GLU . 5.4 Cg_endo -47.06 -26.68 5.31 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 124.908 3.739 . . . . 0.0 115.023 -167.028 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.416 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 8.7 mm-40 -52.5 0.7 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.921 170.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.976 ' HG3' ' HA ' ' A' ' 943' ' ' ILE . 0.0 OUTLIER -106.9 -25.17 11.77 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 109.74 -0.466 . . . . 0.0 109.74 179.31 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.493 ' O ' ' HG2' ' A' ' 954' ' ' MET . 21.6 m-85 -47.02 -42.34 18.07 Favored 'General case' 0 CA--C 1.498 -1.028 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 173.27 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.024 HG13 ' HD3' ' A' ' 953' ' ' PRO 0.25 0.4 OUTLIER -73.89 -58.29 2.17 Favored Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 119.028 -1.069 . . . . 0.0 113.024 178.52 . . . . . . . . 4 4 . 1 . 021 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.024 ' HD3' HG13 ' A' ' 952' ' ' VAL . 36.0 Cg_exo -64.4 -18.52 63.37 Favored 'Trans proline' 0 C--N 1.358 1.075 0 C-N-CA 121.92 1.747 . . . . 0.0 114.631 178.011 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.929 ' HB2' ' HA ' ' A' ' 939' ' ' MET . 22.7 ptt? -70.8 -43.09 69.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 176.797 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.777 ' HB ' ' HB3' ' A' 1002 ' ' MET . 78.9 t -68.54 -27.64 37.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.664 172.329 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 21.4 tptm -52.32 -45.08 65.45 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 171.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' A' ' 954' ' ' MET . 4.7 mm-40 -56.34 -46.77 79.78 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 114.432 -1.258 . . . . 0.0 111.988 177.648 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.567 HG12 ' HA ' ' A' ' 955' ' ' VAL . 9.8 p -81.93 -22.18 9.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -178.546 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.651 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -70.46 -45.34 54.73 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 119.842 -1.17 . . . . 0.0 112.016 -179.885 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.433 HD23 ' HD3' ' A' ' 963' ' ' ARG . 87.5 mt -65.92 -24.35 66.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.686 0.279 . . . . 0.0 110.443 170.642 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -61.8 -55.41 30.28 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.665 175.865 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.917 HD13 ' HB2' ' A' ' 995' ' ' LEU . 6.7 tt -66.4 -27.45 67.86 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.501 -0.479 . . . . 0.0 110.656 179.609 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.433 ' HD3' HD23 ' A' ' 960' ' ' LEU . 17.1 mtp180 -65.69 -48.07 73.27 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.961 -0.462 . . . . 0.0 111.287 171.037 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 22.1 m -55.99 -40.52 73.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.739 0.781 . . . . 0.0 109.68 171.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.774 ' CD2' HG22 ' A' ' 929' ' ' VAL . 1.3 tm? -59.32 -28.69 67.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.482 175.151 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 963' ' ' ARG . 0.4 OUTLIER -68.28 -25.08 64.98 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.993 178.982 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 971' ' ' GLU . . . -68.74 -36.96 79.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.101 171.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.779 HG23 ' HA ' ' A' ' 925' ' ' VAL . 2.1 m -64.44 -40.8 96.43 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.379 172.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.577 HG13 HD11 ' A' ' 984' ' ' ILE . 85.4 t -55.35 -32.36 29.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.2 172.091 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.523 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.6 t70 -80.06 -29.53 39.22 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.806 179.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 5.6 mm-40 -64.13 -50.22 69.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.617 1.198 . . . . 0.0 108.828 170.527 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.592 ' OG ' HG21 ' A' ' 980' ' ' THR . 37.0 t -64.55 -23.11 67.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.002 -1.454 . . . . 0.0 111.306 176.312 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.657 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 60.1 tp -57.02 -52.93 70.4 Favored Pre-proline 0 C--O 1.218 -0.558 0 CA-C-O 118.713 -0.661 . . . . 0.0 112.431 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.645 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 51.4 Cg_exo -58.14 -27.99 82.17 Favored 'Trans proline' 0 C--N 1.357 1.024 0 CA-C-N 121.202 1.465 . . . . 0.0 111.044 169.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 1046 ' ' MET . 3.1 t -78.4 -8.56 11.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.508 176.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.998 ' HG ' ' HB3' ' A' ' 981' ' ' HIS . 3.6 tt -70.92 -52.79 9.4 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 118.942 -0.552 . . . . 0.0 111.077 177.347 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.576 ' HD2' ' O ' ' A' ' 973' ' ' LEU . 32.6 Cg_endo -66.64 -18.57 53.87 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 121.291 1.327 . . . . 0.0 111.123 173.069 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -69.89 -55.72 8.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.567 171.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.774 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 3.6 m -171.34 -36.73 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -176.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.639 HG22 ' HB ' ' A' ' 984' ' ' ILE . 6.9 m -58.04 -17.18 16.03 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 -171.008 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.998 ' HB3' ' HG ' ' A' ' 976' ' ' LEU . 5.3 p-80 -48.46 -19.59 0.34 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.811 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 -75.53 -55.19 5.91 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.874 178.5 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.001 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -79.41 -40.17 30.68 Favored 'General case' 0 CA--C 1.504 -0.815 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -179.29 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.639 ' HB ' HG22 ' A' ' 980' ' ' THR . 9.7 tp -54.62 -35.89 33.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 120.286 -0.566 . . . . 0.0 109.719 -172.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 989' ' ' LYS . 9.0 pt-20 -76.33 -38.19 56.3 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.884 176.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.719 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 3.6 ptp -59.37 -50.74 72.79 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.832 -173.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.68 ' N ' ' HG3' ' A' ' 986' ' ' MET . . . -78.58 -37.4 42.68 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.461 -176.434 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.975 ' HA ' HD12 ' A' ' 991' ' ' LEU . 1.4 tm0? -61.86 -40.59 95.88 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.297 -177.255 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 985' ' ' GLU . 38.6 mmtm -59.54 -40.69 88.03 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 173.663 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' A' 1031 ' ' ASP . 0.1 OUTLIER -68.27 -36.07 78.85 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.896 -179.168 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.975 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.3 mt -59.97 -49.38 77.91 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.183 0.516 . . . . 0.0 110.33 178.583 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -54.4 -42.82 70.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.797 -178.184 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 63.0 m -74.69 -38.87 62.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.175 -176.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.536 ' OD2' ' HB1' ' A' 1027 ' ' ALA . 1.0 OUTLIER -89.33 -39.59 13.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -169.784 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.917 ' HB2' HD13 ' A' ' 962' ' ' LEU . 1.5 tm? -61.08 -31.43 71.1 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 168.744 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -59.68 -50.0 75.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.594 175.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -60.63 -32.36 71.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.807 174.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 1.016 HD21 ' HA ' ' A' 1025 ' ' ALA . 0.2 OUTLIER -65.77 -34.52 78.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.888 0.375 . . . . 0.0 110.463 175.668 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 995' ' ' LEU . 78.0 mt -61.99 -35.7 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.585 0.707 . . . . 0.0 109.385 174.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.724 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 40.3 m-80 -85.46 -13.16 50.06 Favored 'General case' 0 C--O 1.209 -1.075 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.507 176.631 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.875 ' HG2' ' HB2' ' A' 1021 ' ' MET . 0.1 OUTLIER -68.76 -40.18 79.87 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.049 0.452 . . . . 0.0 110.251 175.963 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.992 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.8 ptt? -78.64 -34.17 46.66 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 177.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.724 ' HB3' ' HA ' ' A' 1000 ' ' ASN . 81.4 tttt -73.48 -55.71 5.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.95 -177.416 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.1 mp -54.42 -45.16 72.92 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.7 84.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.176 0.512 . . . . 0.0 110.067 177.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.885 ' HG3' HG12 ' A' ' 952' ' ' VAL . 15.5 mm100 -78.69 -9.8 59.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.799 0.809 . . . . 0.0 112.09 178.52 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.591 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.3 tp-100 -77.91 -43.76 29.04 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.439 175.798 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.419 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 2.9 t80 -75.49 -57.56 3.81 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.311 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.425 ' HB ' ' HA ' ' A' 1006 ' ' GLN . 9.9 p 40.09 35.93 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.871 1.268 . . . . 0.0 113.43 172.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.436 ' HG3' ' HB2' ' A' 1013 ' ' LEU . 46.2 tpp -86.11 120.79 27.86 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 175.276 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -51.04 117.55 2.62 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.142 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 20.5 m 77.49 -39.1 0.3 Allowed 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.914 0.886 . . . . 0.0 111.974 178.408 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.436 ' HB2' ' HG3' ' A' 1010 ' ' MET . 8.9 mp -77.74 -8.0 57.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.158 0.504 . . . . 0.0 110.733 179.622 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.58 -25.81 40.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.68 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' 1018 ' ' LYS . 27.9 pt20 -55.15 -33.89 63.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.813 -0.63 . . . . 0.0 112.196 -169.375 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -50.77 -51.12 53.43 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 111.279 173.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.419 ' CD2' ' HB2' ' A' 1008 ' ' TYR . 2.1 m-30 -76.87 -21.61 54.7 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.512 178.309 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.495 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 38.6 ttpt -65.27 -39.82 93.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.425 177.65 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.94 -57.06 13.17 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.319 0.58 . . . . 0.0 109.885 176.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -48.85 -49.7 38.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.461 176.161 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.875 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 0.0 OUTLIER -73.81 -19.0 60.88 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.435 -176.759 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.55 -48.09 65.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 174.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.2 m -63.93 -33.76 76.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.361 177.301 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -62.93 -33.6 75.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 178.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 1.016 ' HA ' HD21 ' A' ' 998' ' ' LEU . . . -69.69 -31.28 69.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 178.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.536 ' O ' HG23 ' A' 1030 ' ' VAL . 22.5 t-80 -64.88 -34.59 78.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.379 176.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.536 ' HB1' ' OD2' ' A' ' 994' ' ' ASP . . . -57.57 -46.94 83.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.054 175.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.858 HD13 ' HG ' ' A' ' 998' ' ' LEU . 0.6 OUTLIER -62.49 -46.27 89.21 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.88 0.847 . . . . 0.0 110.554 177.39 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -55.81 -36.98 68.05 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.732 -179.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' 1026 ' ' HIS . 88.6 t -65.9 -35.7 75.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 173.283 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.666 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.7 p30 -70.72 -39.21 73.52 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.108 -178.478 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -61.71 -53.43 56.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.073 171.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.597 ' O ' ' HG ' ' A' 1036 ' ' LEU . 2.9 tmtp? -60.32 -48.21 82.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.048 -174.195 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.612 ' O ' HG23 ' A' 1038 ' ' VAL . 8.9 t30 -64.86 -36.53 84.64 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.823 -176.016 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.884 HD22 HD11 ' A' ' 991' ' ' LEU . 15.4 tp -78.98 -33.18 45.34 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 119.694 -0.193 . . . . 0.0 110.516 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.887 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.2 pp -67.64 -18.35 64.93 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 120.961 0.41 . . . . 0.0 109.899 -178.967 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 20.3 t70 -88.73 -38.91 14.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.222 169.771 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.001 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -50.68 -61.56 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.938 173.136 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.887 HD11 ' HA ' ' A' 1036 ' ' LEU . 1.7 pp -78.58 -24.22 13.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.125 -178.136 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.686 ' N ' HD12 ' A' 1039 ' ' ILE . 13.8 t0 -59.56 -36.18 75.71 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 164.809 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' 1045 ' ' LYS . 26.8 mm-40 -72.57 -36.58 68.23 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.208 -0.997 . . . . 0.0 109.678 170.695 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.641 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -51.66 -53.22 41.2 Favored 'General case' 0 CA--C 1.521 -0.136 0 O-C-N 123.223 0.327 . . . . 0.0 111.241 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.938 ' HB2' ' HG2' ' A' ' 920' ' ' ARG . 7.7 ppt_? -52.42 -38.99 60.42 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.699 176.009 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.638 ' N ' ' HD2' ' A' 1043 ' ' ARG . 48.2 tp -80.47 -23.42 40.22 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 121.001 -0.279 . . . . 0.0 111.29 177.487 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.774 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 28.5 mmmt -62.95 -42.68 99.89 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.668 0.747 . . . . 0.0 109.062 176.077 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.477 ' HB2' HG13 ' A' ' 975' ' ' VAL . 1.6 tmt? -61.84 -39.19 90.98 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.191 175.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 37.4 mm -61.05 -36.6 73.59 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.67 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.255 173.618 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.0 t -62.4 -21.9 65.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.869 0.366 . . . . 0.0 111.04 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -85.77 -38.62 18.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.071 178.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 23.5 t -83.19 -26.98 30.34 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.282 0.563 . . . . 0.0 110.345 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -121.53 89.01 46.99 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.165 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.502 ' HG2' ' HD2' ' A' 1053 ' ' HIS . 72.6 Cg_endo -81.43 -23.39 5.06 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.538 2.159 . . . . 0.0 112.654 -179.258 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.502 ' HD2' ' HG2' ' A' 1052 ' ' PRO . 13.3 p80 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.404 -0.807 . . . . 0.0 109.909 179.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.767 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 20.5 tpt180 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 18.3 m 70.88 5.57 5.51 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 123.073 0.549 . . . . 0.0 110.646 -177.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.5 OUTLIER 55.67 78.15 0.2 Allowed 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.317 171.981 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.514 ' CG ' ' HG3' ' A' 1043 ' ' ARG . 2.4 p30 -55.03 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 112.356 -2.202 . . . . 0.0 112.257 -176.006 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.559 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 3.4 tmtp? -25.38 -25.24 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.238 1.415 . . . . 0.0 114.384 177.092 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.845 HG21 ' HG2' ' A' 1043 ' ' ARG . 13.4 m -62.79 -52.79 55.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 174.263 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.522 ' N ' HG23 ' A' ' 925' ' ' VAL . 60.9 t80 -77.59 -31.17 52.85 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.163 0.982 . . . . 0.0 108.586 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.501 ' O ' ' HB ' ' A' ' 930' ' ' THR . 39.8 mt-10 -68.0 -49.77 59.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.931 -179.407 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.559 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 41.3 t30 -73.96 -30.33 62.47 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -175.145 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.693 HG22 HD11 ' A' ' 965' ' ' LEU . 45.2 t -64.75 -42.39 94.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.811 173.25 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.714 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 54.7 m -50.57 -29.4 10.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.204 0.526 . . . . 0.0 110.007 165.397 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . 0.407 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -70.77 -27.97 71.52 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.822 178.125 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.766 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 6.2 tt -64.61 -45.58 86.28 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.033 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.683 ' O ' HG12 ' A' ' 937' ' ' ILE . 35.2 t -57.04 -45.69 84.05 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.38 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.726 173.214 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.714 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.9 mmpt? -56.21 -45.5 79.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.701 178.117 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.69 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -77.48 -26.08 51.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.866 -177.41 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.597 HG12 ' HA ' ' A' ' 933' ' ' VAL . 8.4 p -80.44 -15.76 12.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.466 172.895 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.683 HG12 ' O ' ' A' ' 933' ' ' VAL . 25.0 mm -69.19 -28.06 37.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 168.479 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.555 ' HG2' ' HA ' ' A' ' 935' ' ' ALA . 11.1 mm-40 -62.49 -47.05 85.67 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.256 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.493 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 24.1 ttt -57.05 -38.44 73.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.704 174.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.622 ' O ' ' HG2' ' A' ' 944' ' ' GLN . 19.5 m -67.29 -40.73 86.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.127 179.934 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.5 t -76.43 -42.78 42.89 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 -177.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 946' ' ' ALA . 7.6 mmtm -48.45 -56.18 8.94 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 113.534 -1.666 . . . . 0.0 111.293 175.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.685 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 15.4 tt -66.61 -25.26 34.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 O-C-N 123.651 0.594 . . . . 0.0 112.006 -173.518 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.794 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 81.4 mm-40 -51.92 -59.54 8.01 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-O 119.44 -0.314 . . . . 0.0 111.777 -179.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.794 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 85.0 Cg_endo -100.64 14.9 0.42 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.631 1.554 . . . . 0.0 113.555 174.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.645 ' HB2' ' O ' ' A' ' 942' ' ' LYS . . . -75.75 137.59 70.11 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -174.341 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 950' ' ' GLU . 93.3 Cg_endo -85.63 178.74 4.22 Favored 'Trans proline' 0 N--CA 1.456 -0.697 0 C-N-CA 123.141 2.561 . . . . 0.0 109.47 160.05 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.642 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 8.5 Cg_endo -51.45 -36.66 59.64 Favored 'Trans proline' 0 C--O 1.247 0.97 0 C-N-CA 122.479 2.119 . . . . 0.0 111.943 176.572 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -59.44 -16.16 21.82 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.582 -179.898 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.541 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . 0.8 OUTLIER -114.36 -9.49 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.558 179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.725 ' O ' ' HG2' ' A' ' 954' ' ' MET . 24.4 m-85 -58.65 -41.83 86.95 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.584 0.706 . . . . 0.0 109.523 172.702 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.995 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -73.68 -52.04 5.01 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 119.686 -0.805 . . . . 0.0 111.374 177.236 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.995 ' HD3' HG13 ' A' ' 952' ' ' VAL . 83.2 Cg_exo -56.04 -27.46 64.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.963 1.775 . . . . 0.0 115.152 173.262 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.725 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 24.8 ptt? -68.5 -42.98 77.83 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.676 0.751 . . . . 0.0 109.601 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.769 ' HB ' ' SD ' ' A' 1002 ' ' MET . 65.3 t -71.32 -24.73 24.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.581 174.739 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.615 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 48.0 tttm -56.47 -43.56 79.69 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 173.469 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.449 ' HB3' ' HB2' ' A' ' 938' ' ' GLU . 4.5 mm-40 -54.05 -47.87 71.17 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.106 173.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.578 HG12 ' O ' ' A' ' 955' ' ' VAL . 4.5 p -69.94 -21.12 23.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.116 177.936 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.615 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -63.59 -41.43 99.13 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 170.575 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 41.6 tp -73.74 -10.18 59.42 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.248 0.547 . . . . 0.0 110.275 175.333 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.766 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -76.14 -56.4 4.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.468 -177.774 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.496 ' HA ' ' HB3' ' A' ' 965' ' ' LEU . 59.7 tp -76.02 -17.15 59.8 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.844 0.355 . . . . 0.0 110.43 175.399 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.787 ' HE ' ' HA ' ' A' ' 963' ' ' ARG . 0.3 OUTLIER -64.71 -65.76 0.63 Allowed 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.472 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 967' ' ' ALA . 6.1 m -58.52 -22.09 54.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.353 175.479 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.693 HD11 HG22 ' A' ' 929' ' ' VAL . 19.8 tp -75.4 -36.81 60.8 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.5 -33.99 56.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.829 172.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 964' ' ' THR . . . -58.46 -49.84 75.89 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.916 0.389 . . . . 0.0 110.179 173.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.78 HG21 ' HA ' ' A' ' 925' ' ' VAL . 9.4 m -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.961 171.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . . . . . . . . . 98.9 t -54.79 -32.02 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 O-C-N 122.384 -0.198 . . . . 0.0 110.715 174.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.476 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 10.6 t70 -69.17 -32.31 71.54 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.309 176.319 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 60.1 mm-40 -60.59 -57.86 10.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 122.294 1.045 . . . . 0.0 109.111 172.651 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.531 ' OG ' HG21 ' A' ' 980' ' ' THR . 41.3 t -66.52 -22.69 66.17 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.341 -1.3 . . . . 0.0 112.264 -178.003 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.772 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 42.1 tp -61.67 -48.61 89.44 Favored Pre-proline 0 C--O 1.217 -0.644 0 N-CA-C 113.169 0.803 . . . . 0.0 113.169 -177.082 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.727 ' O ' ' HD2' ' A' ' 977' ' ' PRO . 31.5 Cg_exo -63.54 -26.87 69.71 Favored 'Trans proline' 0 C--N 1.356 0.933 0 CA-C-N 121.58 1.6 . . . . 0.0 110.683 167.904 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.715 HG12 ' HE2' ' A' 1045 ' ' LYS . 19.4 t -74.34 -12.63 15.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.545 176.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.772 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 0.7 OUTLIER -72.16 -54.0 6.06 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.128 177.778 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 24.4 Cg_exo -63.51 -22.61 70.93 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.392 1.395 . . . . 0.0 110.643 178.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -61.25 2.33 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.027 171.759 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.999 ' HB2' ' HD3' ' A' 1045 ' ' LYS . 29.0 m -161.07 -42.62 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.659 HG22 ' HB ' ' A' ' 984' ' ' ILE . 18.3 m -45.97 -21.1 0.11 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.14 1.534 . . . . 0.0 115.14 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.703 ' HB2' ' HG ' ' A' ' 976' ' ' LEU . 78.7 t60 -47.63 -36.48 10.96 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -172.726 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HG3' ' H ' ' A' ' 983' ' ' GLU . 4.9 ptp180 -61.52 -56.07 24.11 Favored 'General case' 0 C--N 1.314 -0.938 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.739 176.747 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.798 ' HG3' HG22 ' A' 1038 ' ' VAL . 0.6 OUTLIER -76.79 -49.33 16.13 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.141 -0.623 . . . . 0.0 112.025 -174.793 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.661 ' HA ' HG11 ' A' 1038 ' ' VAL . 11.2 tt -50.58 -42.29 21.72 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.376 -174.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -68.1 -30.17 69.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.982 -177.16 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.68 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 14.5 ptm -62.51 -57.1 12.39 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.121 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.71 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -79.92 -34.94 38.53 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -176.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.77 ' HA ' HD12 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -55.48 -52.68 62.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.951 0.405 . . . . 0.0 110.44 -177.407 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -73.16 -23.91 60.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.64 . . . . 0.0 109.854 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.645 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 18.6 tp -65.9 -51.66 56.71 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.718 175.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.77 HD12 ' HA ' ' A' ' 988' ' ' GLN . 9.4 mt -53.08 -52.1 59.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.644 175.264 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 47.6 t-20 -48.09 -43.05 30.36 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 114.948 -1.024 . . . . 0.0 110.358 178.329 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 50.4 m -65.02 -50.54 65.86 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.901 -178.001 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.637 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.3 m-20 -94.86 -25.41 16.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -169.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.615 HD21 ' HA2' ' A' ' 959' ' ' GLY . 2.9 tm? -52.84 -55.5 22.61 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.859 0.754 . . . . 0.0 109.265 165.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -52.71 -41.16 63.68 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.639 173.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.83 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.5 mm-40 -58.04 -48.58 79.66 Favored 'General case' 0 C--O 1.214 -0.809 0 O-C-N 123.779 0.674 . . . . 0.0 109.782 178.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.786 HD22 ' HA ' ' A' 1025 ' ' ALA . 31.2 tp -72.32 -32.79 66.84 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.567 0.542 . . . . 0.0 110.252 -172.426 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.795 ' O ' ' HG2' ' A' 1002 ' ' MET . 37.6 mm -63.5 -56.29 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 122.678 1.227 . . . . 0.0 107.931 173.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.715 ' O ' ' HB2' ' A' 1004 ' ' LEU . 43.0 t30 -58.22 -13.5 5.18 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-N 113.825 -1.534 . . . . 0.0 112.458 172.047 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.83 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 71.5 mmtt -87.24 -40.42 14.56 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.223 0.919 . . . . 0.0 111.081 172.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.795 ' HG2' ' O ' ' A' ' 999' ' ' ILE . 12.0 ptt? -61.89 -34.67 76.45 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 174.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.742 ' O ' ' HB2' ' A' 1007 ' ' GLN . 38.6 ttmt -70.91 -57.98 4.05 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 113.844 -1.525 . . . . 0.0 108.556 172.62 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' A' 1000 ' ' ASN . 2.9 tt -48.33 -57.88 5.38 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.714 0.634 . . . . 0.0 111.589 -173.659 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.407 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -60.1 -48.37 81.99 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.078 0.466 . . . . 0.0 110.562 -175.456 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.601 ' HA ' HG23 ' A' 1009 ' ' VAL . 29.2 mm-40 -79.11 -15.32 58.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.112 -176.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.742 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.0 tp-100 -87.09 -37.94 16.94 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.417 177.851 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.484 ' HD2' ' CG ' ' A' 1017 ' ' TYR . 19.7 t80 -83.31 -8.67 59.39 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.854 -176.428 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' 1006 ' ' GLN . 54.0 t -36.32 109.46 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 O-C-N 124.21 0.944 . . . . 0.0 112.89 179.357 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.504 ' HG2' HG22 ' A' 1011 ' ' THR . 24.4 ttt -100.83 -75.34 0.59 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.169 172.789 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.504 HG22 ' HG2' ' A' 1010 ' ' MET . 8.9 t 178.13 125.61 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.653 174.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.7 m 70.51 -49.96 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.503 0.721 . . . . 0.0 111.758 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.427 ' O ' ' HB3' ' A' 1016 ' ' GLU . 95.6 mt -65.99 -4.95 8.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 123.432 0.693 . . . . 0.0 111.843 -179.013 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.55 ' HG2' HG22 ' A' 1009 ' ' VAL . 0.5 OUTLIER -52.04 -43.42 63.74 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -177.494 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.577 ' OE1' ' HD3' ' A' 1018 ' ' LYS . 6.0 tp-100 -51.37 -35.38 38.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.584 -177.077 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.514 ' HA ' ' HE3' ' A' 1019 ' ' LYS . 2.6 tp10 -56.54 -59.62 4.73 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.338 0.589 . . . . 0.0 111.483 171.589 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' 1017 ' ' TYR . 0.1 OUTLIER -50.06 -39.39 41.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.711 177.466 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.577 ' HD3' ' OE1' ' A' 1015 ' ' GLN . 86.4 tttt -60.98 -31.58 71.17 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.693 -1.14 . . . . 0.0 113.136 177.244 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' 1016 ' ' GLU . 89.8 mttt -58.5 -48.98 79.01 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.639 0.733 . . . . 0.0 109.23 177.028 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -51.96 -43.05 63.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.378 177.806 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.712 ' HA ' ' HB3' ' A' 1001 ' ' LYS . 14.1 tmm? -65.12 -48.24 74.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.798 179.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.81 -32.85 74.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 -175.379 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 30.2 m -68.88 -47.06 66.83 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.081 0.467 . . . . 0.0 110.202 177.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.732 ' HB3' ' HG3' ' A' 1001 ' ' LYS . . . -64.51 -35.62 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.271 177.888 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.786 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -60.87 -42.1 97.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.131 0.491 . . . . 0.0 110.446 176.132 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.572 ' O ' HG23 ' A' 1030 ' ' VAL . 58.1 t60 -69.14 -33.16 73.01 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.138 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -63.37 -46.92 84.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.119 176.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.567 HD13 ' N ' ' A' ' 995' ' ' LEU . 17.9 tp -59.72 -47.2 86.59 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.268 0.556 . . . . 0.0 110.27 177.206 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -54.69 -32.33 59.28 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.258 174.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 1026 ' ' HIS . 89.9 t -72.46 -40.22 63.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 O-C-N 122.076 -0.39 . . . . 0.0 110.546 172.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.637 ' OD2' ' HB2' ' A' ' 994' ' ' ASP . 28.0 m-20 -57.7 -47.16 83.14 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.697 173.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' 1036 ' ' LEU . . . -52.74 -39.45 62.16 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.292 169.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' 1036 ' ' LEU . 35.2 tttm -71.93 -35.08 69.53 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.375 -176.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.593 ' O ' HG23 ' A' 1038 ' ' VAL . 66.2 t30 -70.8 -54.51 11.37 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 -178.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.832 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 15.2 tp -64.02 -28.35 69.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' 1040 ' ' ASP . 55.1 tp -51.37 -44.35 62.08 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.685 174.03 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.61 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 19.4 t70 -91.45 -26.92 18.61 Favored 'General case' 0 C--O 1.22 -0.461 0 O-C-N 124.105 0.878 . . . . 0.0 110.692 -179.345 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.832 ' HB ' ' HA ' ' A' 1035 ' ' LEU . 25.2 t -57.42 -57.46 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 C-N-CA 123.12 0.568 . . . . 0.0 111.967 177.04 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.728 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 7.9 pt -86.92 -27.37 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.947 -178.11 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.61 ' HB3' ' HA ' ' A' 1037 ' ' ASP . 2.4 t70 -44.21 -48.38 9.32 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 157.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.675 ' HA ' ' HB3' ' A' 1044 ' ' LEU . 23.4 tt0 -78.23 -23.84 47.24 Favored 'General case' 0 C--O 1.192 -1.936 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.494 176.428 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.851 ' O ' ' HG3' ' A' 1045 ' ' LYS . . . -56.29 -47.36 78.81 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.619 0.723 . . . . 0.0 111.504 175.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.845 ' HG2' HG21 ' A' ' 925' ' ' VAL . 5.9 mmm180 -79.46 -23.68 42.91 Favored 'General case' 0 C--N 1.309 -1.174 0 O-C-N 121.469 -0.769 . . . . 0.0 110.917 177.11 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.675 ' HB3' ' HA ' ' A' 1041 ' ' GLN . 50.0 tp -78.38 -29.2 47.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.096 0.474 . . . . 0.0 110.498 175.474 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.999 ' HD3' ' HB2' ' A' ' 979' ' ' SER . 0.1 OUTLIER -71.42 -25.7 62.44 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 176.518 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 59.7 ttp -73.89 -28.69 61.68 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.603 175.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' 1044 ' ' LEU . 45.0 mm -69.89 -32.8 53.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 168.232 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.739 ' HB2' ' O ' ' A' 1045 ' ' LYS . 44.0 m -57.56 -23.75 52.34 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.245 172.541 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -69.57 -53.63 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 174.128 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' 1051 ' ' ARG . 6.3 m -63.37 -59.69 4.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.677 179.257 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.927 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 46.2 mtp180 88.34 -88.09 0.0 OUTLIER Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 125.303 1.441 . . . . 0.0 112.999 179.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.927 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 2.8 Cg_endo -79.81 97.95 1.11 Allowed 'Trans proline' 0 C--N 1.362 1.24 0 CA-C-N 121.656 1.627 . . . . 0.0 112.438 -173.579 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 17.2 t60 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.408 177.075 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.788 ' HG2' ' HB3' ' A' 1043 ' ' ARG . 21.1 tpt180 . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 920' ' ' ARG . 47.9 m -61.22 126.55 27.74 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 164.365 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.509 ' HB2' ' HB3' ' A' ' 926' ' ' TYR . 0.1 OUTLIER -64.29 84.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.529 0.681 . . . . 0.0 112.475 -170.599 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.748 ' HB3' ' HE ' ' A' 1043 ' ' ARG . 11.1 t70 -47.04 -174.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 112.311 -2.222 . . . . 0.0 112.75 -174.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.48 ' HD3' ' HB2' ' A' ' 928' ' ' ASN . 2.9 tmtm? -36.03 -27.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.146 0.978 . . . . 0.0 111.96 -179.869 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.876 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 3.3 m -55.32 -53.64 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-O 119.16 -0.448 . . . . 0.0 112.049 175.19 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 922' ' ' ASN . 23.5 t80 -75.74 -33.92 60.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.344 -0.942 . . . . 0.0 108.634 -174.091 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -46.36 75.53 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.308 -1.315 . . . . 0.0 111.585 -173.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.48 ' HB2' ' HD3' ' A' ' 924' ' ' LYS . 4.1 t30 -73.97 -38.99 64.01 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.677 -174.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.624 HG22 ' CD2' ' A' ' 965' ' ' LEU . 12.0 t -65.24 -33.62 64.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.403 178.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.485 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 3.9 p -72.73 -27.44 62.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 171.095 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . 0.427 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -60.78 -30.61 73.15 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.342 167.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.813 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -62.86 -38.2 89.89 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 174.901 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.565 ' HA ' HG12 ' A' ' 936' ' ' VAL . 70.3 t -65.27 -41.37 91.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.495 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.587 ' O ' ' HB ' ' A' ' 937' ' ' ILE . 11.2 mmpt? -60.72 -33.69 73.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.013 0.435 . . . . 0.0 110.284 177.458 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.719 ' HB3' ' HB2' ' A' ' 961' ' ' ALA . . . -78.97 -26.21 43.43 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.562 -178.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.572 ' HA ' HG12 ' A' ' 958' ' ' VAL . 12.9 p -82.87 -12.05 12.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.792 0.806 . . . . 0.0 109.334 171.72 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 59.2 mt -70.55 -41.26 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.092 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.648 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 56.5 mm-40 -53.74 -43.09 68.85 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.038 169.747 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.591 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 24.7 ttt -58.29 -41.15 83.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.562 177.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.701 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 40.6 m -67.83 -41.23 83.35 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.923 -179.764 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.517 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 11.8 p -76.39 -40.62 50.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -175.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.644 ' HB3' ' HB2' ' A' ' 954' ' ' MET . 7.8 mmtp -53.63 -49.58 67.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.468 -1.242 . . . . 0.0 112.126 178.829 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.586 HD12 ' HE1' ' A' ' 954' ' ' MET . 17.5 tt -71.28 -27.75 30.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.785 -173.437 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.809 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 91.9 mt-30 -56.42 -63.21 3.66 Favored Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.42 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.809 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 92.6 Cg_endo -97.34 -12.12 0.49 Allowed 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.451 1.434 . . . . 0.0 114.378 -175.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -95.86 152.28 38.92 Favored Pre-proline 0 C--N 1.323 -0.573 0 O-C-N 122.073 -0.392 . . . . 0.0 112.007 -172.003 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 946' ' ' ALA . 2.8 Cg_exo -76.89 178.7 7.29 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.584 2.856 . . . . 0.0 112.432 -178.212 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.721 ' HA ' ' CG ' ' A' ' 951' ' ' TYR . 50.0 Cg_exo -55.88 -27.32 62.37 Favored 'Trans proline' 0 C--O 1.245 0.852 0 C-N-CA 122.821 2.347 . . . . 0.0 112.561 176.233 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -55.73 -27.45 50.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.047 173.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.484 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.7 OUTLIER -102.03 -5.1 24.97 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.342 175.782 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.721 ' CG ' ' HA ' ' A' ' 948' ' ' PRO . 6.8 m-30 -56.45 -43.71 79.76 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.108 ' HA ' ' HB2' ' A' 1002 ' ' MET . 0.2 OUTLIER -74.68 -51.8 3.87 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 119.97 -0.692 . . . . 0.0 112.159 176.689 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.03 ' HD3' HG13 ' A' ' 952' ' ' VAL . 93.7 Cg_exo -51.86 -32.89 48.8 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.167 1.911 . . . . 0.0 113.972 173.632 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.644 ' HB2' ' HB3' ' A' ' 942' ' ' LYS . 0.0 OUTLIER -60.02 -54.91 40.39 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.878 0.847 . . . . 0.0 110.633 178.553 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.826 ' HB ' ' HB3' ' A' 1002 ' ' MET . 94.2 t -63.22 -26.5 41.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.151 172.539 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.424 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 19.2 tptm -65.01 -27.26 68.7 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.046 177.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -59.33 -46.51 88.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.308 172.057 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.856 HG21 HD23 ' A' ' 998' ' ' LEU . 2.5 m -72.29 -24.08 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.24 175.869 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' A' ' 995' ' ' LEU . . . -71.02 -43.51 57.16 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.265 -0.969 . . . . 0.0 111.141 176.521 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.88 -33.16 68.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.424 . . . . 0.0 110.246 170.263 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.813 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -58.86 -56.48 21.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.32 179.841 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 991' ' ' LEU . 6.9 tt -71.43 -31.62 67.43 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.506 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -58.07 -55.51 34.04 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.815 -0.553 . . . . 0.0 111.148 171.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 21.6 m -58.78 -33.02 69.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.525 0.679 . . . . 0.0 110.339 174.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.647 ' HB3' ' HA ' ' A' ' 962' ' ' LEU . 1.8 tm? -63.53 -34.12 77.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.291 174.512 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 35.6 tp -62.46 -25.81 68.18 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.348 178.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.96 -43.05 84.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.175 0.512 . . . . 0.0 110.085 171.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.674 ' CG2' ' HA ' ' A' ' 925' ' ' VAL . 6.9 m -61.89 -37.44 84.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.294 173.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 965' ' ' LEU . 97.5 t -58.14 -31.25 41.35 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.115 174.457 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.47 ' O ' ' CD ' ' A' ' 974' ' ' PRO . 22.0 t70 -76.79 -23.61 52.88 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.067 0.46 . . . . 0.0 110.824 178.405 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.552 ' O ' HG23 ' A' ' 975' ' ' VAL . 63.8 mm-40 -70.52 -53.71 15.07 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.379 1.085 . . . . 0.0 108.839 169.7 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.716 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.8 t -66.95 -25.95 66.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.094 -1.412 . . . . 0.0 112.149 -178.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.697 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 57.3 tp -62.59 -53.21 59.15 Favored Pre-proline 0 C--O 1.218 -0.595 0 CA-C-O 118.863 -0.589 . . . . 0.0 112.297 -176.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 75.1 Cg_exo -54.86 -32.22 76.48 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 120.928 1.367 . . . . 0.0 111.297 169.193 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.8 t -77.46 -10.47 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.591 177.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.739 ' HG ' ' CB ' ' A' ' 981' ' ' HIS . 2.3 tt -65.59 -53.2 38.84 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.182 176.761 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.623 ' HD2' ' O ' ' A' ' 974' ' ' PRO . 37.6 Cg_exo -61.87 -33.55 84.17 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 121.353 1.369 . . . . 0.0 110.842 173.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.96 27.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.918 175.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.844 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 8.7 m -170.73 -26.95 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -177.601 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.718 ' HA ' ' HG3' ' A' 1045 ' ' LYS . 37.2 m -63.2 -20.92 65.86 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.733 1.382 . . . . 0.0 114.733 -170.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.739 ' CB ' ' HG ' ' A' ' 976' ' ' LEU . 1.8 p80 -50.79 -21.91 1.89 Allowed 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -171.72 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -69.2 -54.5 14.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 119.883 -0.727 . . . . 0.0 110.535 -179.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 1.018 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.5 OUTLIER -77.99 -43.07 30.66 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.662 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.6 ' HB ' HG22 ' A' ' 980' ' ' THR . 10.6 tp -60.23 -29.14 43.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.512 -175.031 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.37 -36.67 63.57 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.426 172.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 20.6 ptm -68.92 -52.73 26.3 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.991 -175.767 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.678 ' HB2' HG21 ' A' 1038 ' ' VAL . . . -78.19 -46.22 21.05 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.487 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' A' ' 991' ' ' LEU . 23.2 tp60 -60.64 -37.56 81.88 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.291 -175.126 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -59.6 -41.94 91.44 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.737 0.78 . . . . 0.0 109.173 174.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' A' ' 987' ' ' ALA . 0.1 OUTLIER -72.77 -35.68 67.5 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.973 179.417 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 1.034 HD12 ' HA ' ' A' ' 988' ' ' GLN . 21.0 mt -60.72 -50.13 74.71 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.626 0.727 . . . . 0.0 109.837 179.164 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -56.67 -41.87 78.01 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.235 -175.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 11.5 p -75.54 -33.2 60.66 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -178.248 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.09 -41.87 10.26 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -171.327 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.82 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.6 OUTLIER -59.56 -39.11 82.95 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 171.141 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -54.86 -48.93 72.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.771 178.251 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 993' ' ' SER . 62.6 mm-40 -57.61 -38.93 75.76 Favored 'General case' 0 CA--C 1.509 -0.633 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.373 179.434 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.856 HD23 HG21 ' A' ' 958' ' ' VAL . 14.9 tp -70.39 -29.8 66.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.089 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.506 ' O ' ' HG2' ' A' 1002 ' ' MET . 44.4 mt -61.82 -35.75 69.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.893 173.506 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.653 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 41.9 m-80 -88.42 -5.5 58.23 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.101 177.276 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.657 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 5.2 mptp? -86.19 -34.64 20.44 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 174.687 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.108 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 26.9 ptt? -73.47 -35.95 65.77 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 171.978 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.774 ' O ' ' HB2' ' A' 1007 ' ' GLN . 87.3 tttt -62.27 -56.89 14.1 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.213 174.663 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.636 ' HB2' ' O ' ' A' 1000 ' ' ASN . 5.0 mp -64.97 -35.79 82.33 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 178.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -63.31 -47.36 82.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.899 0.857 . . . . 0.0 109.851 177.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -8.4 56.88 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.196 177.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.774 ' HB2' ' O ' ' A' 1003 ' ' LYS . 2.0 tp-100 -90.42 -21.18 22.05 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.397 178.561 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 77.9 t80 -116.26 3.76 13.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.807 -174.876 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.477 ' HA ' ' CG ' ' A' 1014 ' ' GLN . 6.4 p -49.91 102.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.911 -178.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 52.4 ttp -148.5 112.75 5.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.144 177.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 56.0 p 46.28 -104.55 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.839 -1.073 . . . . 0.0 113.346 173.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 6.3 t -124.35 -0.88 8.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.346 0.593 . . . . 0.0 109.773 -176.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . . . . . . . . . 22.8 tp -83.66 -9.37 58.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.978 -177.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.477 ' CG ' ' HA ' ' A' 1009 ' ' VAL . 0.3 OUTLIER -61.0 -21.86 63.98 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.48 -179.896 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' A' 1019 ' ' LYS . 27.3 pt20 -55.32 -33.9 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.561 -176.412 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' A' 1020 ' ' GLN . 33.6 tt0 -50.19 -49.17 53.39 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 170.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -80.04 -14.6 58.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 179.228 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.472 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 56.8 tttp -68.63 -36.19 78.28 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 171.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' 1015 ' ' GLN . 32.5 mmtp -68.67 -55.26 12.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.457 176.396 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' 1016 ' ' GLU . 49.5 mm-40 -48.37 -38.42 19.27 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.849 173.11 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.469 ' HB3' ' O ' ' A' 1018 ' ' LYS . 37.8 ttm -58.79 -57.47 12.86 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 176.346 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 48.2 tp -60.49 -34.97 74.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -179.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 61.8 m -60.71 -40.17 91.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.873 177.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.419 ' HB2' ' HE3' ' A' 1001 ' ' LYS . . . -78.69 -31.28 46.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.507 179.201 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.552 ' HA ' HD22 ' A' ' 998' ' ' LEU . . . -65.15 -41.12 95.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.2 176.348 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.646 ' O ' HG23 ' A' 1030 ' ' VAL . 12.8 t-80 -63.84 -40.0 95.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.949 174.177 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' 1030 ' ' VAL . . . -65.87 -45.94 80.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.07 -179.599 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.82 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.1 -28.77 64.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.504 0.668 . . . . 0.0 110.232 178.204 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.479 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.63 -41.43 85.94 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.682 -0.636 . . . . 0.0 109.694 171.483 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' 1026 ' ' HIS . 48.1 t -59.95 -30.75 46.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.468 174.167 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.492 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.8 p30 -76.5 -40.93 48.76 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.579 -0.849 . . . . 0.0 109.804 178.723 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -58.45 -52.64 64.77 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 121.252 0.549 . . . . 0.0 110.718 175.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.59 ' HA ' ' CD2' ' A' 1036 ' ' LEU . 19.7 pttp -65.89 -32.18 73.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -172.055 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.527 ' O ' HG23 ' A' 1038 ' ' VAL . 64.9 t30 -73.6 -35.69 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.139 179.551 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.763 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 11.0 tp -76.33 -32.5 58.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 -178.154 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.858 ' HA ' HD11 ' A' 1039 ' ' ILE . 4.4 pp -66.54 -23.61 66.25 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.27 -39.53 25.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.566 169.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 1.018 HG13 ' HB3' ' A' ' 983' ' ' GLU . 5.0 t -53.58 -65.41 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.117 -0.947 . . . . 0.0 112.792 175.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.876 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 pp -74.86 -27.06 19.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.348 -177.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.739 ' H ' HD12 ' A' 1039 ' ' ILE . 11.7 t70 -50.35 -45.56 55.18 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.268 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.732 ' O ' ' HG2' ' A' 1045 ' ' LYS . 47.6 mt-30 -76.75 -28.69 55.84 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 113.573 -1.649 . . . . 0.0 111.031 176.017 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.657 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.84 -55.98 19.15 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.973 0.806 . . . . 0.0 111.729 176.536 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.788 ' HB3' ' HG2' ' A' ' 920' ' ' ARG . 1.4 mpt_? -58.49 -31.37 67.8 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.924 174.433 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.1 tp -76.38 -20.91 56.7 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.848 175.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.844 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.2 mmtt -67.41 -32.66 73.71 Favored 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.151 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 15.5 tmm? -69.12 -37.43 78.34 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.795 176.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.499 ' CG1' ' HB2' ' A' ' 920' ' ' ARG . 49.2 mm -65.47 -37.77 80.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.919 172.82 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' 1045 ' ' LYS . 70.3 m -58.07 -42.62 85.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.721 177.492 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -75.43 -44.39 44.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.852 178.594 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 12.1 m -100.16 31.15 3.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.476 -174.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.4 ' HG3' ' CE1' ' A' 1053 ' ' HIS . 15.6 ptp180 -53.65 139.66 49.67 Favored Pre-proline 0 C--O 1.235 0.323 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.212 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.93 119.75 7.2 Favored 'Trans proline' 0 C--N 1.343 0.237 0 C-N-CA 123.211 2.607 . . . . 0.0 113.256 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.4 ' CE1' ' HG3' ' A' 1051 ' ' ARG . 42.6 m80 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.57 -0.729 . . . . 0.0 109.698 176.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.433 ' HG2' ' HG3' ' A' 1043 ' ' ARG . 15.0 tpt180 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 28.1 t -85.04 84.37 7.74 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.616 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER -11.61 87.28 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.065 1.746 . . . . 0.0 114.114 -175.459 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.885 ' HB2' ' HG2' ' A' 1043 ' ' ARG . 2.2 t0 -47.22 -173.4 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 112.552 -2.113 . . . . 0.0 113.275 -174.238 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HA ' ' HB2' ' A' ' 927' ' ' GLU . 1.4 tmtp? -37.25 -24.7 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.922 -1.035 . . . . 0.0 112.209 177.594 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.849 ' HB ' ' HB ' ' A' 1039 ' ' ILE . 5.3 m -56.45 -52.15 56.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 122.615 0.366 . . . . 0.0 111.899 172.955 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.553 ' HD1' ' CD2' ' A' 1036 ' ' LEU . 4.8 t80 -68.88 -29.58 67.9 Favored 'General case' 0 C--N 1.34 0.195 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -178.173 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 924' ' ' LYS . 6.3 mm-40 -68.39 -65.55 0.68 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.092 -1.413 . . . . 0.0 113.374 -173.881 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.685 HD21 ' HB ' ' A' ' 968' ' ' THR . 22.0 p-10 -73.24 -30.73 63.67 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.526 -0.469 . . . . 0.0 111.503 -172.556 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.654 HG22 ' CD1' ' A' ' 965' ' ' LEU . 45.9 t -64.02 -37.15 79.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.936 -0.306 . . . . 0.0 111.335 177.204 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.557 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 12.2 p -73.28 -28.02 61.88 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 171.275 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . 0.516 ' HA2' ' CG ' ' A' ' 934' ' ' LYS . . . -58.52 -28.27 62.15 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 114.699 -1.137 . . . . 0.0 112.546 169.18 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.689 ' HG ' ' HB1' ' A' ' 961' ' ' ALA . 3.7 tt -66.02 -44.58 84.31 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 174.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.552 ' O ' HG12 ' A' ' 937' ' ' ILE . 66.1 t -57.81 -38.06 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.588 172.193 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 930' ' ' THR . 9.8 mmpt? -62.96 -36.12 82.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 175.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.666 ' O ' ' HB2' ' A' ' 938' ' ' GLU . . . -74.94 -25.81 59.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.642 -179.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.593 ' HA ' HG12 ' A' ' 958' ' ' VAL . 14.5 p -81.6 -16.41 12.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.558 172.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 933' ' ' VAL . 47.6 mm -69.26 -37.48 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 165.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 44.2 mm-40 -53.87 -37.38 63.63 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.704 171.367 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.666 ' HG3' ' HG3' ' A' ' 954' ' ' MET . 59.6 ttp -58.87 -45.65 89.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.73 -0.471 . . . . 0.0 109.73 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.585 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 31.8 m -71.87 -28.62 63.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 178.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.616 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 20.0 m -77.36 -41.17 41.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.138 0.971 . . . . 0.0 108.391 -176.48 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.55 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 6.8 mmtp -59.22 -42.07 90.13 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 113.532 -1.667 . . . . 0.0 111.955 179.318 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.457 ' HB ' ' SD ' ' A' ' 954' ' ' MET . 14.6 tt -71.66 -24.55 23.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.065 -176.168 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.782 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 76.4 mt-30 -55.82 -62.68 4.2 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 179.618 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.782 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 88.2 Cg_endo -100.49 12.25 0.52 Allowed 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.749 1.633 . . . . 0.0 114.26 -176.103 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' A' ' 950' ' ' GLU . . . -131.47 155.24 81.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -174.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.726 ' HB2' ' HD2' ' A' ' 948' ' ' PRO . 42.3 Cg_endo -93.21 -169.37 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 123.886 3.058 . . . . 0.0 112.701 -177.304 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.726 ' HD2' ' HB2' ' A' ' 947' ' ' PRO . 94.7 Cg_exo -49.51 -32.8 28.4 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 123.282 2.655 . . . . 0.0 113.559 176.464 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.541 ' O ' ' HG2' ' A' ' 953' ' ' PRO . 73.4 mm-40 -53.63 -20.9 5.83 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.917 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.533 ' HB2' ' HB1' ' A' ' 946' ' ' ALA . 0.4 OUTLIER -118.73 -6.86 10.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.565 -178.591 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.758 ' O ' ' HG2' ' A' ' 954' ' ' MET . 2.9 m-85 -55.98 -48.55 75.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.136 0.494 . . . . 0.0 109.951 175.139 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.055 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -76.09 -44.69 3.75 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 119.106 -1.037 . . . . 0.0 111.702 176.829 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.055 ' HD3' HG13 ' A' ' 952' ' ' VAL . 89.4 Cg_exo -55.16 -27.98 58.83 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.597 2.198 . . . . 0.0 115.462 172.28 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.758 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 18.6 ptp -69.33 -44.78 70.97 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.182 0.991 . . . . 0.0 108.764 175.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.776 ' CG1' ' HA ' ' A' ' 999' ' ' ILE . 59.4 t -59.91 -27.66 39.01 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.912 169.547 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.512 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 27.6 ttpt -66.39 -33.13 75.02 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.684 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.06 -45.46 79.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.573 175.691 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 955' ' ' VAL . 2.8 m -70.51 -24.99 26.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.266 175.293 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -73.39 -43.79 36.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.824 177.786 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.9 -24.87 68.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.088 0.471 . . . . 0.0 109.903 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.689 ' HB1' ' HG ' ' A' ' 932' ' ' LEU . . . -65.57 -49.8 67.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.334 173.307 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.876 ' HB2' ' HG ' ' A' ' 995' ' ' LEU . 18.0 tp -59.83 -40.71 89.37 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 172.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -54.87 -55.58 28.89 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.001 0.429 . . . . 0.0 111.15 172.323 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 44.0 m -55.67 -42.44 75.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.723 0.773 . . . . 0.0 110.43 174.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.663 HD21 HD22 ' A' ' 991' ' ' LEU . 9.9 tp -54.53 -40.13 68.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.834 176.248 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.403 ' O ' ' HB ' ' A' ' 969' ' ' VAL . 9.6 tt -59.85 -33.38 71.71 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.77 -178.645 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.68 86.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.104 0.478 . . . . 0.0 110.261 175.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.843 HG23 HG12 ' A' ' 925' ' ' VAL . 0.8 OUTLIER -70.65 -34.05 71.63 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.825 175.401 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 966' ' ' LEU . 98.7 t -55.81 -30.28 27.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.302 173.943 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.6 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 24.2 t70 -80.85 -29.52 35.81 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 177.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 46.3 mm-40 -69.41 -42.82 74.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 123.114 1.435 . . . . 0.0 108.186 171.167 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 1.018 ' HA ' HG22 ' A' ' 975' ' ' VAL . 33.2 t -68.01 -22.73 64.97 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 113.29 -1.777 . . . . 0.0 111.673 174.515 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.779 ' O ' ' HG ' ' A' ' 976' ' ' LEU . 6.5 tt -58.45 -53.46 65.91 Favored Pre-proline 0 C--O 1.213 -0.854 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.082 179.199 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.627 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 43.5 Cg_exo -59.73 -34.72 95.99 Favored 'Trans proline' 0 C--N 1.353 0.802 0 CA-C-N 121.419 1.542 . . . . 0.0 111.911 173.178 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 1.018 HG22 ' HA ' ' A' ' 972' ' ' SER . 19.7 m -77.23 -10.12 12.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 118.975 -1.09 . . . . 0.0 111.306 -178.613 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.905 ' HA ' ' HB ' ' A' ' 980' ' ' THR . 3.3 pp -81.98 -40.16 0.95 Allowed Pre-proline 0 CA--C 1.537 0.479 0 CA-C-O 118.307 -0.854 . . . . 0.0 113.187 -177.208 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.477 ' HD3' ' HG ' ' A' ' 976' ' ' LEU . 44.1 Cg_endo -69.89 -27.22 26.1 Favored 'Trans proline' 0 C--N 1.36 1.177 0 CA-C-N 121.669 1.632 . . . . 0.0 109.662 172.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -57.87 -58.26 9.19 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.554 172.336 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 18.4 m -167.94 -6.55 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.444 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.905 ' HB ' ' HA ' ' A' ' 976' ' ' LEU . 88.2 m -88.07 -23.24 23.79 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -169.643 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.583 ' HA ' HG22 ' A' ' 984' ' ' ILE . 19.8 t60 -50.72 -34.93 28.84 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 119.002 0.819 . . . . 0.0 111.435 -172.973 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -59.78 -52.95 63.26 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.738 174.75 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.717 ' HB3' HG13 ' A' 1038 ' ' VAL . 1.1 tp10 -74.71 -47.95 28.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.92 -178.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.744 ' HA ' HG11 ' A' 1038 ' ' VAL . 8.4 tp -54.84 -38.77 45.58 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -173.261 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.427 ' OE1' ' HA ' ' A' ' 985' ' ' GLU . 5.2 mm-40 -73.13 -27.7 61.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.881 -179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.617 ' HG2' ' O ' ' A' ' 983' ' ' GLU . 11.1 ptt? -63.5 -50.52 69.31 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.136 178.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.585 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -80.29 -42.63 22.73 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.745 -178.601 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.429 HE21 ' HB3' ' A' ' 988' ' ' GLN . 1.0 OUTLIER -61.59 -42.34 98.72 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.028 -173.306 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.547 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 11.0 tmtt? -65.55 -41.39 93.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 175.646 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.76 -50.48 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.167 177.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.663 HD22 HD21 ' A' ' 965' ' ' LEU . 2.9 pp -74.55 -29.32 61.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.761 0.315 . . . . 0.0 111.441 -175.232 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.484 ' N ' HD12 ' A' ' 991' ' ' LEU . 26.7 t-20 -58.14 -43.38 87.29 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 174.478 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.5 m -76.34 -27.34 56.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.193 -174.249 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -103.98 -44.76 4.93 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -170.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.011 ' HA ' HD12 ' A' 1028 ' ' LEU . 0.1 OUTLIER -55.77 -50.18 71.14 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 173.157 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.603 ' O ' HG12 ' A' ' 999' ' ' ILE . . . -57.51 -45.69 84.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.825 176.796 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.73 -35.38 77.9 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' A' 1001 ' ' LYS . 1.2 tm? -72.3 -36.21 68.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.903 -174.124 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.776 ' HA ' ' CG1' ' A' ' 955' ' ' VAL . 28.7 pt -65.45 -27.05 40.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.208 0.528 . . . . 0.0 110.46 177.226 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.605 ' O ' ' HB2' ' A' 1004 ' ' LEU . 53.2 m-80 -93.35 -6.14 47.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.692 175.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.67 ' HB2' ' HA ' ' A' ' 998' ' ' LEU . 20.9 tptt -85.31 -46.83 10.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -175.797 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.703 ' HB3' HG21 ' A' ' 955' ' ' VAL . 56.9 tpp -79.85 -32.91 40.51 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 174.36 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.747 ' O ' ' HB2' ' A' 1007 ' ' GLN . 41.7 ttmt -55.28 -49.06 73.06 Favored 'General case' 0 C--O 1.212 -0.883 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 172.118 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.605 ' HB2' ' O ' ' A' 1000 ' ' ASN . 28.9 tp -53.86 -50.9 65.24 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 123.901 0.751 . . . . 0.0 112.293 171.288 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.465 ' HA ' ' CB ' ' A' 1017 ' ' TYR . . . -58.48 -46.45 86.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.251 0.548 . . . . 0.0 110.979 179.85 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.528 ' OE1' ' HB3' ' A' ' 948' ' ' PRO . 20.6 mm-40 -77.43 -7.61 56.44 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.314 178.286 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.747 ' HB2' ' O ' ' A' 1003 ' ' LYS . 1.2 tp-100 -89.82 -9.41 49.27 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.136 174.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . . . . . . . . . 57.1 t80 -130.79 13.61 5.33 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.661 -1.154 . . . . 0.0 109.068 -178.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.574 HG23 ' HG3' ' A' 1014 ' ' GLN . 6.5 p -53.47 108.99 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.45 ' HB3' ' HB2' ' A' 1013 ' ' LEU . 13.9 tpt -147.65 154.3 40.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.153 -178.81 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 58.3 m -51.56 118.69 3.51 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 123.19 0.306 . . . . 0.0 110.972 179.646 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.704 ' O ' ' HG2' ' A' 1015 ' ' GLN . 40.7 t 74.38 -49.1 0.66 Allowed 'General case' 0 N--CA 1.466 0.357 0 O-C-N 123.99 0.806 . . . . 0.0 111.481 -177.818 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.45 ' HB2' ' HB3' ' A' 1010 ' ' MET . 3.3 mm? -64.24 -17.66 63.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.574 ' HG3' HG23 ' A' 1009 ' ' VAL . 0.8 OUTLIER -59.16 -43.34 92.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.809 0.338 . . . . 0.0 110.146 178.308 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' 1012 ' ' SER . 3.4 pt20 -67.81 -21.82 65.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.822 -175.033 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' 1019 ' ' LYS . 25.8 tt0 -57.89 -55.63 32.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.422 0.629 . . . . 0.0 109.521 174.967 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.487 ' CD2' ' HG ' ' A' 1004 ' ' LEU . 5.7 m-30 -74.94 -15.17 60.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.1 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.585 ' HB3' ' HA ' ' A' 1015 ' ' GLN . 39.3 ttpt -78.19 -42.53 31.19 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 121.154 -0.219 . . . . 0.0 110.582 179.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' 1016 ' ' GLU . 17.2 ptpt -69.04 -20.86 64.13 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.615 0.721 . . . . 0.0 109.405 176.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.411 ' HG2' ' HE3' ' A' 1001 ' ' LYS . 6.1 tt0 -78.64 -42.74 27.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.086 177.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.478 ' HG3' ' HA ' ' A' 1018 ' ' LYS . 3.6 ppp? -74.91 -27.13 60.09 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.38 178.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 53.1 tp -63.56 -44.09 95.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.159 0.504 . . . . 0.0 110.21 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 44.1 m -65.87 -31.13 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.575 177.6 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.85 -35.16 44.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -65.17 -31.49 72.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.264 177.146 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.493 ' O ' HG23 ' A' 1030 ' ' VAL . 31.0 t60 -67.51 -34.05 76.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.772 174.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -75.76 -41.65 52.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.164 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.011 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -71.49 -32.05 67.81 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.337 0.589 . . . . 0.0 110.605 179.953 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.611 ' N ' HD23 ' A' 1028 ' ' LEU . . . -56.65 -38.67 72.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.142 0.496 . . . . 0.0 110.314 171.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' 1026 ' ' HIS . 96.2 t -65.81 -34.2 68.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.052 174.594 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' 1028 ' ' LEU . 1.6 p30 -72.76 -39.86 66.48 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.894 -0.722 . . . . 0.0 110.858 -172.546 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.546 ' HB2' HD22 ' A' ' 932' ' ' LEU . . . -61.05 -54.31 46.4 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.084 0.468 . . . . 0.0 110.444 174.459 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.413 ' HA ' ' HB3' ' A' 1036 ' ' LEU . 20.0 ttpt -71.74 -22.89 61.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.372 -173.291 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.473 ' O ' HG23 ' A' 1038 ' ' VAL . 9.7 t30 -73.94 -32.32 63.45 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.168 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 984' ' ' ILE . 19.6 tp -76.46 -33.61 58.72 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.659 ' HA ' HD11 ' A' 1039 ' ' ILE . 0.0 OUTLIER -48.24 -42.56 30.71 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 174.733 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.636 ' N ' HD13 ' A' 1036 ' ' LEU . 23.1 t70 -72.39 -45.3 60.36 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.174 0.511 . . . . 0.0 110.057 177.147 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.744 HG11 ' HA ' ' A' ' 984' ' ' ILE . 40.8 t -48.32 -63.55 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.684 175.673 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.849 ' HB ' ' HB ' ' A' ' 925' ' ' VAL . 1.7 pp -78.77 -29.01 14.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -174.098 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.734 ' H ' HD12 ' A' 1039 ' ' ILE . 1.0 OUTLIER -50.53 -48.49 57.19 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 166.09 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.748 ' O ' ' HG2' ' A' 1045 ' ' LYS . 22.7 mt-30 -74.78 -32.49 62.05 Favored 'General case' 0 C--O 1.2 -1.544 0 CA-C-N 113.413 -1.721 . . . . 0.0 111.22 175.592 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.778 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -52.28 -55.45 21.28 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 118.763 0.711 . . . . 0.0 112.109 178.778 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.885 ' HG2' ' HB2' ' A' ' 923' ' ' ASP . 4.0 tpt180 -54.65 -35.95 64.05 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.418 174.296 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.92 -26.17 59.43 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.297 175.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 73.2 mmtt -65.39 -32.79 74.6 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.44 ' HB2' HG12 ' A' ' 975' ' ' VAL . 1.7 tmt? -64.45 -40.02 94.93 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.248 -0.887 . . . . 0.0 108.811 175.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 50.6 mm -65.11 -37.15 79.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.954 172.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.435 ' HB3' ' O ' ' A' 1045 ' ' LYS . 33.2 t -59.19 -37.52 77.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.107 0.48 . . . . 0.0 110.533 177.026 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.424 HE21 ' HB3' ' A' 1049 ' ' GLN . 1.0 OUTLIER -72.64 -29.47 63.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.302 178.835 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 25.9 m -84.37 -31.98 24.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.053 -178.559 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 26.7 tpt180 -156.55 105.37 2.0 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.775 179.079 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -88.26 21.27 1.02 Allowed 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.964 2.442 . . . . 0.0 113.138 -176.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.579 -0.724 . . . . 0.0 110.532 -179.873 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.778 ' CD ' ' HB2' ' A' 1044 ' ' LEU . 4.1 ttt-85 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 33.5 m 60.31 15.36 5.33 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.868 0.467 . . . . 0.0 111.923 -178.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 0.0 OUTLIER 43.06 52.46 5.35 Favored 'General case' 0 CA--C 1.498 -1.022 0 C-N-CA 123.522 0.729 . . . . 0.0 110.845 -174.479 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.477 ' O ' ' N ' ' A' ' 925' ' ' VAL . 23.5 t0 -46.56 -175.19 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 O-C-N 125.638 1.837 . . . . 0.0 111.867 -179.2 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.651 ' HD2' ' OG1' ' A' ' 968' ' ' THR . 2.9 tmtm? -34.33 -25.23 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 124.032 0.933 . . . . 0.0 112.46 178.523 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.755 ' HA ' HG21 ' A' ' 968' ' ' THR . 4.5 m -56.52 -50.66 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 174.028 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' A' 1036 ' ' LEU . 27.2 t80 -76.94 -35.41 57.3 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -177.476 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -60.64 -53.65 54.93 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 113.607 -1.633 . . . . 0.0 111.546 -177.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -65.18 -44.99 86.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.203 -173.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.909 ' HB ' HD23 ' A' 1036 ' ' LEU . 16.6 t -60.92 -34.84 61.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.076 -0.649 . . . . 0.0 111.217 177.419 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.656 ' O ' ' HG2' ' A' ' 934' ' ' LYS . 87.6 m -60.67 -39.37 88.15 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 173.137 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.61 70.01 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 114.982 -1.008 . . . . 0.0 113.318 174.131 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.909 ' HA ' ' HB1' ' A' ' 961' ' ' ALA . 10.8 tp -68.41 -35.0 77.01 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 117.738 0.769 . . . . 0.0 109.51 176.361 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 936' ' ' VAL . 45.9 t -70.33 -38.56 74.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.3 0.571 . . . . 0.0 110.028 172.359 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.656 ' HG2' ' O ' ' A' ' 930' ' ' THR . 10.6 mmpt? -64.29 -25.35 68.01 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.462 177.23 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.597 ' CB ' ' HB2' ' A' ' 961' ' ' ALA . . . -75.37 -29.96 60.04 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.257 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 933' ' ' VAL . 10.2 p -79.7 -13.67 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.043 173.29 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 934' ' ' LYS . 47.0 mm -73.37 -42.48 57.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.574 166.202 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.534 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 17.2 mm-40 -52.6 -41.94 64.11 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.222 169.273 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.545 ' HA ' ' HB2' ' A' ' 954' ' ' MET . 14.4 ttt -59.09 -41.06 87.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.895 177.756 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.61 ' O ' ' HG3' ' A' ' 944' ' ' GLN . 19.9 m -66.25 -37.07 84.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.133 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.506 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 19.1 m -77.67 -40.36 41.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -176.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.704 ' HB3' ' HB3' ' A' ' 954' ' ' MET . 5.6 mmtp -62.95 -40.02 96.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 113.583 -1.644 . . . . 0.0 111.457 -179.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.714 HD12 ' HB3' ' A' ' 946' ' ' ALA . 9.5 tp -73.98 -23.19 18.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 O-C-N 123.127 0.267 . . . . 0.0 111.216 -177.831 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.667 ' HB2' ' HD3' ' A' ' 945' ' ' PRO . 77.6 mt-30 -53.52 -54.09 49.52 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 119.46 -0.305 . . . . 0.0 111.706 177.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.667 ' HD3' ' HB2' ' A' ' 944' ' ' GLN . 63.1 Cg_endo -100.54 21.66 0.22 Allowed 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.999 1.799 . . . . 0.0 113.473 173.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 943' ' ' ILE . . . -89.21 128.57 51.01 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -173.289 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.45 ' O ' ' HD1' ' A' ' 951' ' ' TYR . 1.8 Cg_endo -84.99 179.2 4.32 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.465 2.777 . . . . 0.0 108.489 159.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.584 ' HA ' ' CD1' ' A' ' 951' ' ' TYR . 7.1 Cg_endo -50.86 -34.64 46.02 Favored 'Trans proline' 0 C--O 1.245 0.829 0 C-N-CA 122.167 1.912 . . . . 0.0 111.731 178.061 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.433 ' O ' ' CD ' ' A' ' 953' ' ' PRO . 17.8 mm-40 -55.6 -37.49 68.19 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.353 178.224 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.547 ' HA ' ' HD2' ' A' ' 953' ' ' PRO . 1.8 mp0 -96.45 -5.55 39.36 Favored 'General case' 0 C--O 1.232 0.183 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 178.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.584 ' CD1' ' HA ' ' A' ' 948' ' ' PRO . 10.6 m-85 -57.75 -42.12 83.3 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 172.713 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.016 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -71.79 -51.98 8.43 Favored Pre-proline 0 CA--C 1.555 1.14 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.246 177.168 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.016 ' HD3' HG13 ' A' ' 952' ' ' VAL . 96.8 Cg_exo -51.42 -41.06 61.4 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 122.734 2.29 . . . . 0.0 115.135 174.629 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.704 ' HB3' ' HB3' ' A' ' 942' ' ' LYS . 14.8 ptt? -60.21 -50.06 75.15 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-O 121.706 0.765 . . . . 0.0 110.093 -179.012 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.737 ' HB ' ' HB3' ' A' 1002 ' ' MET . 2.7 t -63.54 -26.82 41.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 C-N-CA 119.541 -0.864 . . . . 0.0 110.785 174.302 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 39.1 ttmt -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 178.415 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 5.1 mm-40 -56.0 -46.96 78.58 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.45 174.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 1.018 HG23 HD22 ' A' ' 998' ' ' LEU . 3.1 m -68.66 -26.27 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.834 177.474 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.455 ' HA2' HD21 ' A' ' 998' ' ' LEU . . . -75.18 -44.11 23.92 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.061 -1.066 . . . . 0.0 112.58 -179.804 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.6 -25.03 64.29 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.912 0.387 . . . . 0.0 110.482 172.26 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.909 ' HB1' ' HA ' ' A' ' 932' ' ' LEU . . . -63.24 -52.98 59.94 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.069 174.645 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 1.021 ' HB2' HD23 ' A' ' 995' ' ' LEU . 18.0 tp -53.3 -44.92 68.7 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.055 0.389 . . . . 0.0 111.213 172.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' A' ' 966' ' ' LEU . 30.1 mmm180 -56.26 -54.87 40.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.954 0.407 . . . . 0.0 111.122 177.274 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.4 m -53.81 -43.21 69.17 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.464 0.65 . . . . 0.0 110.945 174.796 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.601 HD21 HD12 ' A' 1035 ' ' LEU . 36.6 tp -61.92 -37.11 83.44 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.598 179.157 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 963' ' ' ARG . 59.0 tp -52.92 -36.56 59.74 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.182 178.097 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -62.02 -45.06 95.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.151 0.5 . . . . 0.0 110.335 174.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.755 HG21 ' HA ' ' A' ' 925' ' ' VAL . 5.7 m -66.46 -34.02 77.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.121 0.486 . . . . 0.0 111.415 174.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.652 HG13 HD11 ' A' ' 984' ' ' ILE . 73.3 t -55.25 -31.72 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.509 172.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.627 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.9 t70 -76.63 -22.78 53.65 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.242 177.72 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.661 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 50.7 mm-40 -68.99 -50.79 45.9 Favored 'General case' 0 C--O 1.245 0.823 0 CA-C-O 122.972 1.368 . . . . 0.0 108.587 170.128 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.631 ' OG ' HG21 ' A' ' 980' ' ' THR . 40.3 t -65.53 -24.93 67.24 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.34 177.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.69 ' O ' ' HB3' ' A' ' 976' ' ' LEU . 38.3 tp -61.11 -48.87 90.83 Favored Pre-proline 0 C--O 1.217 -0.616 0 CA-C-O 118.633 -0.699 . . . . 0.0 112.619 -176.319 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.661 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 32.3 Cg_exo -61.57 -27.98 82.45 Favored 'Trans proline' 0 C--N 1.355 0.876 0 CA-C-N 121.246 1.481 . . . . 0.0 110.578 170.24 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 971' ' ' GLU . 2.6 t -76.86 -10.31 13.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 119.749 -0.78 . . . . 0.0 110.496 175.676 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.69 ' HB3' ' O ' ' A' ' 973' ' ' LEU . 3.7 tt -68.04 -53.82 18.36 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-O 118.875 -0.584 . . . . 0.0 111.226 176.303 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.62 ' HD3' ' O ' ' A' ' 973' ' ' LEU . 32.5 Cg_exo -62.9 -24.32 74.22 Favored 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 121.437 1.425 . . . . 0.0 111.054 174.36 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -64.51 -56.83 11.52 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.585 172.886 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.802 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 4.7 m -169.02 -33.24 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.728 HG22 ' HB ' ' A' ' 984' ' ' ILE . 8.3 m -54.99 -19.57 7.11 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -174.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.611 ' CA ' ' HG ' ' A' ' 976' ' ' LEU . 83.5 t60 -48.5 -20.12 0.4 Allowed 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -175.363 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 982' ' ' ARG . 23.6 ttt85 -77.4 -55.52 5.33 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.301 179.203 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.92 ' HB3' HG13 ' A' 1038 ' ' VAL . 0.1 OUTLIER -79.57 -43.76 22.39 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -177.11 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.728 ' HB ' HG22 ' A' ' 980' ' ' THR . 7.9 tp -56.04 -37.86 50.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.796 -170.406 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 14.7 pt-20 -75.76 -40.71 54.84 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.146 177.034 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.731 ' HG2' ' HA ' ' A' ' 983' ' ' GLU . 13.8 ptp -61.25 -50.15 74.2 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.555 -173.918 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 991' ' ' LEU . . . -78.6 -32.67 47.64 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 119.752 -0.166 . . . . 0.0 111.204 -177.737 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 984' ' ' ILE . 8.4 tt0 -62.38 -50.32 72.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.34 -179.887 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -65.16 -32.03 73.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.351 0.596 . . . . 0.0 109.935 175.386 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.676 ' HB3' ' HA ' ' A' ' 987' ' ' ALA . 11.3 tp -61.14 -58.86 6.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.353 176.611 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.801 ' HB3' ' HB3' ' A' 1031 ' ' ASP . 3.1 pp -70.86 -19.05 62.68 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.447 -176.728 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 996' ' ' ALA . 6.7 t30 -59.61 -38.17 80.59 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 173.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 996' ' ' ALA . 50.5 m -77.6 -30.47 52.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -178.832 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.649 ' HB2' ' OD2' ' A' 1031 ' ' ASP . 1.4 m-20 -103.36 -27.49 12.4 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 119.629 -0.828 . . . . 0.0 112.4 -175.473 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.021 HD23 ' HB2' ' A' ' 962' ' ' LEU . 7.1 mp -71.8 -15.74 62.16 Favored 'General case' 0 C--O 1.218 -0.581 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 163.088 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . 0.604 ' O ' ' HB ' ' A' ' 999' ' ' ILE . . . -68.88 -41.82 77.81 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 166.308 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 994' ' ' ASP . 7.8 mm-40 -58.26 -33.21 69.15 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.952 171.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 1.018 HD22 HG23 ' A' ' 958' ' ' VAL . 0.6 OUTLIER -58.33 -35.64 72.19 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.013 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.604 ' HB ' ' O ' ' A' ' 996' ' ' ALA . 1.7 mp -60.24 -42.78 91.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.449 175.4 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.706 ' HA ' ' HB3' ' A' 1003 ' ' LYS . 92.5 m-20 -77.69 -19.37 55.43 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.307 177.284 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.715 ' HD3' ' HA ' ' A' ' 998' ' ' LEU . 9.2 mtpm? -66.9 -44.53 80.57 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.165 0.507 . . . . 0.0 109.781 174.823 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.925 ' HB2' ' HA ' ' A' ' 952' ' ' VAL . 22.3 ptp -76.59 -36.38 57.57 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.789 ' O ' ' HB2' ' A' 1007 ' ' GLN . 23.4 tptm -67.5 -62.59 1.34 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.893 -179.335 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' 1017 ' ' TYR . 2.9 tt -52.19 -56.17 16.33 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.454 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . . . . . . . . . . . -59.75 -53.59 56.14 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.301 -174.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.98 -17.99 64.6 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.169 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.789 ' HB2' ' O ' ' A' 1003 ' ' LYS . 4.8 tp-100 -88.56 -38.45 14.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.469 0.652 . . . . 0.0 110.755 -176.491 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.586 ' CD2' ' CE1' ' A' 1017 ' ' TYR . 0.2 OUTLIER -103.37 7.89 38.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.285 -172.476 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.534 ' HA ' ' OE1' ' A' 1014 ' ' GLN . 7.5 p -41.62 124.68 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 114.276 -1.329 . . . . 0.0 113.213 -174.987 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.61 ' SD ' HD12 ' A' 1013 ' ' LEU . 40.1 ttm -150.8 57.09 0.92 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.059 175.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 20.2 m 50.52 -93.54 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.045 -0.98 . . . . 0.0 113.352 175.905 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 22.7 t -77.73 -27.92 50.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.266 0.555 . . . . 0.0 110.575 -174.162 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.61 HD12 ' SD ' ' A' 1010 ' ' MET . 60.5 mt -78.37 -5.87 53.52 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.621 179.068 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.571 ' NE2' ' HD2' ' A' 1017 ' ' TYR . 8.8 tp60 -60.96 -25.23 66.68 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-O 121.725 0.774 . . . . 0.0 110.295 179.076 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' 1018 ' ' LYS . 0.7 OUTLIER -65.54 -41.08 93.42 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.875 -179.473 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -50.22 -52.13 38.53 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.698 173.138 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.825 ' HB3' HD22 ' A' 1004 ' ' LEU . 0.9 OUTLIER -73.96 -19.44 60.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.343 0.592 . . . . 0.0 110.595 -178.242 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' 1015 ' ' GLN . 23.1 tptm -71.34 -46.06 61.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.89 171.179 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -58.05 -56.42 22.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.159 176.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -47.94 -41.32 24.57 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.825 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.539 ' HB2' ' HG2' ' A' 1001 ' ' LYS . 2.6 ptp -77.27 -23.34 51.2 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.998 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 67.3 tp -69.05 -39.76 78.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.143 0.497 . . . . 0.0 109.944 179.064 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 20.7 m -64.97 -33.75 76.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.05 175.362 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . . . . . . . . . . . -78.34 -26.78 46.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.386 177.865 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . . . . . . . . . . . -70.83 -37.08 73.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.193 177.927 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.492 ' O ' HG23 ' A' 1030 ' ' VAL . 20.3 t60 -66.6 -42.91 86.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.63 175.627 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -62.65 -51.2 68.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.115 178.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 995' ' ' LEU . 0.0 OUTLIER -64.75 -33.71 76.62 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 120.783 0.325 . . . . 0.0 110.691 -179.089 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.587 ' N ' HD23 ' A' 1028 ' ' LEU . . . -58.06 -43.16 86.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.362 172.908 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' 1026 ' ' HIS . 96.0 t -67.35 -38.97 81.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 177.186 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.801 ' HB3' ' HB3' ' A' ' 991' ' ' LEU . 4.9 m-20 -61.24 -44.49 97.18 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.846 177.529 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . . . . . . . . . . . -54.39 -57.04 12.82 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.964 0.412 . . . . 0.0 110.351 167.651 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' 1036 ' ' LEU . 84.9 mttt -66.22 -22.99 66.35 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -170.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.641 ' O ' HG23 ' A' 1038 ' ' VAL . 66.8 t30 -73.34 -41.15 63.83 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.776 175.697 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.737 ' HA ' ' HB ' ' A' 1038 ' ' VAL . 3.3 tm? -75.56 -26.12 57.68 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.605 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.909 HD23 ' HB ' ' A' ' 929' ' ' VAL . 3.1 tm? -54.35 -52.04 62.86 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.198 169.575 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 18.9 t70 -72.34 -36.17 68.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.361 -1.29 . . . . 0.0 108.646 -178.694 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.92 HG13 ' HB3' ' A' ' 983' ' ' GLU . 18.3 t -51.69 -60.8 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.333 174.373 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.706 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 29.1 pt -89.83 -24.48 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 112.346 0.498 . . . . 0.0 112.346 -171.711 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -53.63 -48.25 69.53 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 162.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' A' 1045 ' ' LYS . 31.7 mt-30 -74.43 -21.65 59.51 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.248 176.366 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.706 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -52.94 -54.04 40.77 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 118.801 0.728 . . . . 0.0 110.625 171.567 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.703 ' HB3' ' HA ' ' A' ' 920' ' ' ARG . 3.3 mpt_? -53.17 -34.79 58.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 173.411 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.778 ' HB2' ' CD ' ' A' ' 920' ' ' ARG . 3.3 tm? -73.73 -34.13 64.64 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.296 173.82 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.802 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 75.8 mmtt -55.81 -28.31 55.63 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 175.529 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 53.4 ttm -72.12 -46.76 55.38 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.185 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.44 ' HB ' HD22 ' A' 1044 ' ' LEU . 41.0 mm -64.69 -41.85 93.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.821 175.358 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 20.6 t -52.73 -41.58 64.1 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.301 175.782 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 25.1 tm0? -81.18 -30.25 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.357 -178.766 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 36.5 m -76.53 -70.85 0.43 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.611 -177.878 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 71.9 mtm-85 -144.98 98.33 4.77 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.488 -175.305 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.79 77.74 2.22 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.788 2.326 . . . . 0.0 112.093 177.632 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 66.3 t60 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.625 -0.703 . . . . 0.0 109.439 -179.609 . . . . . . . . 0 0 . 1 stop_ save_